A0A096N654_PAPAN Loading...

Crossover junction endonuclease MUS81

Interacts with EME1 to form a DNA structure-specific endonuclease with substrate preference for branched DNA structures with a 5'-end at the branch nick. Typical substrates include 3'-flap structures, D-loops, replication forks and nicked Holliday junctions. May be required in mitosis for the processing of stalled or collapsed replication fork intermediates. May be required in meiosis for the repair of meiosis-specific double strand breaks subsequent to single-end invasion (SEI).

AlphaFold DB , UniProt , Accession A0A096N654, Species PAPAN (Papio anubis, Olive baboon), Gene MUS81, Length 551 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	36.1	Very low	38.4	Very low	251 Å²	251	169.1 Å²	169.1	100%	1.236	88%	0.877	S	S	*	*				0	109.3	0	-72.4	-161.1	-118.3	0	0	108.6
2	A	33.9	Very low	38.4	Very low	104 Å²	104	165 Å²	165	86%	0.86	87%	0.869	S	S	*	*	P	Polyproline II helix	trans	-91.9	131.9	176.4	0	0	0	0	0	109.5
3	A	35.2	Very low	38.8	Very low	92 Å²	92	163.5 Å²	163.5	76%	0.76	86%	0.86	S	S	*	*	P	Polyproline II helix	trans	-66.4	142.7	-178.6	0	0	0	0	0	111.7
4	P	36.5	Very low	39.4	Very low	122 Å²	122	158 Å²	158	79%	0.792	84%	0.839	S	S	*	*	P	Polyproline II helix	trans	-73.9	132.1	-177.9	28.3	-31.9	0	0	0	111.4	R6	P4-R6 PolarHBondContact O-N 3.21Å
5	V	39.7	Very low	40.5	Very low	133 Å²	133	155.3 Å²	155.3	81%	0.806	85%	0.848	S	S	*	*			trans	-65.7	115.7	174.3	177.7	0	0	0	0	109.5	L7	V5-L7 PolarHBondContact O-N 2.82Å
6	R	37.5	Very low	42	Very low	243 Å²	243	148.3 Å²	148.3	92%	0.917	81%	0.814	S	S	*	*			trans	-75.9	103.9	173.1	-71	-171.2	176.1	-158.5	-0.1	109.9	P4 G8	P4-R6 PolarHBondContact O-N 3.21Å; R6-G8 PolarHBondContact O-N 3.33Å
7	L	43.5	Very low	43.9	Very low	161 Å²	161	141.5 Å²	141.5	84%	0.843	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-65.6	116.3	167.1	-69.2	168.3	0	0	0	109.3	V5 R9	V5-L7 PolarHBondContact O-N 2.82Å; L7-R9 PolarHBondContact O-N 2.91Å
8	G	38.1	Very low	46.1	Very low	72 Å²	72	134.1 Å²	134.1	74%	0.742	74%	0.737	S	S	*	*	P	Polyproline II helix	trans	-58.9	132.3	177.7	0	0	0	0	0	112	R6 K10	R6-G8 PolarHBondContact O-N 3.33Å; G8-K10 PolarHBondContact O-N 3.21Å
9	R	43.3	Very low	48.1	Very low	244 Å²	244	131.3 Å²	131.3	92%	0.921	73%	0.726	S	S	*	*	P	Polyproline II helix	trans	-59	126.5	172.7	-71.7	178.9	176.1	178.4	-1.6	109.4	L7 R11	L7-R9 PolarHBondContact O-N 2.91Å; R9-R11 PolarHBondContact O-N 3.25Å; R9-R11 VanDerWaalsContact O-N 3.1Å
10	K	40.9	Very low	50	Low	204 Å²	204	127.8 Å²	127.8	89%	0.887	71%	0.706	S	S	*	*			trans	-56.3	115.1	168	-76.4	-178.1	177.4	177.7	0	108.3	G8	G8-K10 PolarHBondContact O-N 3.21Å
11	R	37.9	Very low	51.9	Low	234 Å²	234	122.1 Å²	122.1	88%	0.883	67%	0.674	S	S	*	*	P	Polyproline II helix	trans	-60.4	130.6	168.5	-73.6	-178.5	-179	-178.4	0	108	R9 L13	R9-R11 PolarHBondContact O-N 3.25Å; R9-R11 VanDerWaalsContact O-N 3.1Å; R11-L13 PolarHBondContact O-N 2.83Å
12	P	38.5	Very low	54.4	Low	120 Å²	120	111 Å²	111	78%	0.779	62%	0.621	S	S	*	*	P	Polyproline II helix	trans	-59.3	128.1	172.2	22.4	-29.4	0	0	0	108.8
13	L	42.9	Very low	57	Low	145 Å²	145	111.4 Å²	111.4	76%	0.759	60%	0.6	S	S	*	*	P	Polyproline II helix	trans	-63.5	131.7	173	-73.1	164.1	0	0	0	108.2	R11	R11-L13 PolarHBondContact O-N 2.83Å
14	P	47.2	Very low	59.7	Low	87 Å²	87	107.3 Å²	107.3	57%	0.565	56%	0.564	S	S	*	*	P	Polyproline II helix	trans	-59.6	144.1	178.9	21.8	-30.5	0	0	0	111	C16	P14-C16 PolarHBondContact O-N 2.94Å
15	A	56.5	Low	62.3	Low	118 Å²	118	101.5 Å²	101.5	98%	0.975	53%	0.527	S	S	*	.	S	Bend	trans	-57.6	-18.7	-176.1	0	0	0	0	0	114.1
16	C	64.5	Low	64.6	Low	43 Å²	43	96.6 Å²	96.6	29%	0.291	50%	0.497	S	S	.	.			trans	-144.9	113.9	167.1	-171.4	0	0	0	0	109.2	P14 N18	P14-C16 PolarHBondContact O-N 2.94Å; C16-N18 PolarHBondContact O-N 3.03Å
17	P	73.8	Confident	67.2	Low	32 Å²	32	88 Å²	88	21%	0.208	47%	0.467	C	S	.	.	S	Bend	trans	-64.9	-18.6	178.6	-23.5	33.8	0	0	0	114.3	P54	P17-P54 VanDerWaalsContact CG-O 3.3Å; P17-P54 WeakPolarHBondContact CG-O 3.38Å
18	N	83.4	Confident	69.6	Low	8 Å²	8	81.8 Å²	81.8	4%	0.043	43%	0.433	C	S	.	.			trans	-131.6	59.3	-172.1	-64.6	-66.5	0	0	0	112.9	C16 L20 F21 V22 L50 L55 P56 L57	C16-N18 PolarHBondContact O-N 3.03Å; N18-L20 PolarHBondContact O-N 2.84Å; N18-F21 PolarHBondContact O-N 2.87Å; N18-V22 WeakPolarHBondContact O-CG2 3.31Å; N18-V22 PolarHBondContact O-N 2.84Å; N18-V22 VanDerWaalsContact O-N 3.11Å; N18-L50 HydrophobicContact CB-CD1 3.85Å; N18-L50 HydrophobicContact CB-CD2 4.37Å; N18-L50 HydrophobicContact CB-CG 4.2Å; N18-L55 PolarHBondContact ND2-O 2.96Å; N18-P56 WeakPolarHBondContact OD1-CA 3.41Å; N18-L57 WeakPolarHBondContact OD1-CB 3.35Å; N18-L57 PolarHBondContact OD1-N 3.38Å
19	P	84	Confident	72.2	Confident	82 Å²	82	81.3 Å²	81.3	53%	0.532	41%	0.409	S	S	.	.	H	α-helix	trans	-65.2	-39	-169.2	25.7	-33.7	0	0	0	113.4	V22 R23	P19-V22 PolarHBondContact O-N 2.92Å; P19-R23 WeakPolarHBondContact O-CB 3.47Å; P19-R23 PolarHBondContact O-N 3.47Å
20	L	87.1	Confident	74.3	Confident	61 Å²	61	72.3 Å²	72.3	32%	0.319	38%	0.379	S	S	.	.	H	α-helix	trans	-65.7	-46.5	-179.8	-66.1	178.1	0	0	0	112.2	N18 V22 R23 W24	N18-L20 PolarHBondContact O-N 2.84Å; L20-V22 VanDerWaalsContact C-N 3.32Å; L20-V22 PolarHBondContact O-N 3.49Å; L20-R23 PolarHBondContact O-N 3.44Å; L20-W24 HydrophobicContact CB-CH2 3.99Å; L20-W24 HydrophobicContact CB-CZ2 3.89Å; L20-W24 HydrophobicContact CB-CZ3 4.44Å; L20-W24 HydrophobicContact CD1-CH2 4.39Å; L20-W24 HydrophobicContact CD1-CZ2 4.39Å; L20-W24 HydrophobicContact CD2-CZ2 4.38Å; L20-W24 HydrophobicContact CG-CZ2 4.45Å; L20-W24 VanDerWaalsContact O-CD2 3.29Å; L20-W24 VanDerWaalsContact O-CG 3.26Å; L20-W24 PolarHBondContact O-N 3.19Å
21	F	89.1	Confident	76.7	Confident	8 Å²	8	67.2 Å²	67.2	4%	0.035	36%	0.358	C	S	.	.	H	α-helix	trans	-67.8	-35.3	179.7	-73.1	12.6	0	0	0	111.2	N18 W24 L25 L50 L57 S59 A63 L77 L81	N18-F21 PolarHBondContact O-N 2.87Å; F21-W24 AromaticContact CD1-CE3 3.74Å; F21-W24 HydrophobicContact CD1-CE3 3.74Å; F21-W24 HydrophobicContact CD1-CH2 4.37Å; F21-W24 AromaticContact CD1-CZ3 3.47Å; F21-W24 HydrophobicContact CD1-CZ3 3.47Å; F21-W24 VanDerWaalsContact CD1-CZ3 3.47Å; F21-W24 HydrophobicContact CE1-CE3 4.22Å; F21-W24 HydrophobicContact CE1-CH2 4.37Å; F21-W24 AromaticContact CE1-CZ3 3.55Å; F21-W24 HydrophobicContact CE1-CZ3 3.55Å; F21-L25 VanDerWaalsContact O-CB 3.32Å; F21-L25 WeakPolarHBondContact O-CB 3.41Å; F21-L25 VanDerWaalsContact O-CG 3.3Å; F21-L25 WeakPolarHBondContact O-CG 3.44Å; F21-L25 PolarHBondContact O-N 2.78Å; F21-L50 HydrophobicContact CB-CD2 3.56Å; F21-L57 HydrophobicContact CD2-CB 4.3Å; F21-L57 HydrophobicContact CD2-CD1 4.22Å; F21-L57 HydrophobicContact CE2-CB 3.91Å; F21-L57 HydrophobicContact CE2-CD1 4.37Å; F21-S59 WeakPolarHBondContact CE2-O 3.44Å; F21-A63 HydrophobicContact CE2-CB 4.39Å; F21-L77 HydrophobicContact CB-CD2 4.43Å; F21-L77 HydrophobicContact CD1-CD2 4.23Å; F21-L77 HydrophobicContact CD2-CD1 4.34Å; F21-L77 HydrophobicContact CG-CD2 4.16Å; F21-L81 HydrophobicContact CE1-CD1 4.3Å; F21-L81 HydrophobicContact CE1-CD2 4.19Å; F21-L81 HydrophobicContact CZ-CD2 4.18Å
22	V	88	Confident	79	Confident	19 Å²	19	56.3 Å²	56.3	12%	0.115	32%	0.318	C	S	.	.	H	α-helix	trans	-63.8	-43.8	173	169.6	0	0	0	0	111.1	N18 P19 L20 T26 L47 L50 R51	N18-V22 WeakPolarHBondContact O-CG2 3.31Å; N18-V22 PolarHBondContact O-N 2.84Å; N18-V22 VanDerWaalsContact O-N 3.11Å; P19-V22 PolarHBondContact O-N 2.92Å; L20-V22 VanDerWaalsContact C-N 3.32Å; L20-V22 PolarHBondContact O-N 3.49Å; V22-T26 WeakPolarHBondContact O-CB 3.34Å; V22-T26 PolarHBondContact O-N 3.29Å; V22-T26 PolarHBondContact O-OG1 3.09Å; V22-L47 HydrophobicContact CG1-CD1 4.19Å; V22-L47 WeakPolarHBondContact O-CD1 3.38Å; V22-L50 HydrophobicContact CG2-CD2 3.61Å; V22-L50 HydrophobicContact CG2-CG 4.05Å; V22-R51 HydrophobicContact CG2-CG 4.43Å
23	R	89	Confident	81.4	Confident	112 Å²	112	53.7 Å²	53.7	42%	0.423	30%	0.3	S	S	.	.	H	α-helix	trans	-59.7	-52.8	176.4	174.7	177.4	147.5	-167	-7.3	111.1	P19 L20 L25 T26 E27 D90	P19-R23 WeakPolarHBondContact O-CB 3.47Å; P19-R23 PolarHBondContact O-N 3.47Å; L20-R23 PolarHBondContact O-N 3.44Å; R23-L25 PolarHBondContact O-N 3.3Å; R23-T26 WeakPolarHBondContact O-CB 3.44Å; R23-T26 PolarHBondContact O-N 2.93Å; R23-T26 VanDerWaalsContact O-N 3.1Å; R23-E27 VanDerWaalsContact CG-OE1 3.22Å; R23-E27 WeakPolarHBondContact CG-OE1 3.46Å; R23-E27 IonicContact NE-OE1 3.9Å; R23-E27 PolarHBondContact NE-OE1 2.85Å; R23-E27 WeakPolarHBondContact O-CG 3.37Å; R23-E27 PolarHBondContact O-N 2.79Å; R23-D90 IonicContact NH1-OD2 2.72Å; R23-D90 PolarHBondContact NH1-OD2 3.41Å
24	W	92.6	Very high	83.6	Confident	5 Å²	5	55.1 Å²	55.1	2%	0.019	30%	0.295	C	S	.	.	H	α-helix	trans	-65.6	-39.4	-177.6	-56.3	-27.5	0	0	0	113.6	L20 F21 T26 E27 W28 L77 R80 L81 H84	L20-W24 HydrophobicContact CB-CH2 3.99Å; L20-W24 HydrophobicContact CB-CZ2 3.89Å; L20-W24 HydrophobicContact CB-CZ3 4.44Å; L20-W24 HydrophobicContact CD1-CH2 4.39Å; L20-W24 HydrophobicContact CD1-CZ2 4.39Å; L20-W24 HydrophobicContact CD2-CZ2 4.38Å; L20-W24 HydrophobicContact CG-CZ2 4.45Å; L20-W24 VanDerWaalsContact O-CD2 3.29Å; L20-W24 VanDerWaalsContact O-CG 3.26Å; L20-W24 PolarHBondContact O-N 3.19Å; F21-W24 AromaticContact CD1-CE3 3.74Å; F21-W24 HydrophobicContact CD1-CE3 3.74Å; F21-W24 HydrophobicContact CD1-CH2 4.37Å; F21-W24 AromaticContact CD1-CZ3 3.47Å; F21-W24 HydrophobicContact CD1-CZ3 3.47Å; F21-W24 VanDerWaalsContact CD1-CZ3 3.47Å; F21-W24 HydrophobicContact CE1-CE3 4.22Å; F21-W24 HydrophobicContact CE1-CH2 4.37Å; F21-W24 AromaticContact CE1-CZ3 3.55Å; F21-W24 HydrophobicContact CE1-CZ3 3.55Å; W24-T26 VanDerWaalsContact C-N 3.26Å; W24-T26 PolarHBondContact O-N 2.94Å; W24-E27 PolarHBondContact O-N 2.87Å; W24-W28 WeakPolarHBondContact O-CB 3.26Å; W24-W28 VanDerWaalsContact O-CG 3.25Å; W24-W28 PolarHBondContact O-N 2.9Å; W24-L77 HydrophobicContact CE3-CD2 3.98Å; W24-R80 HydrophobicContact CD2-CB 4.45Å; W24-R80 HydrophobicContact CD2-CG 3.84Å; W24-R80 HydrophobicContact CE3-CB 4.19Å; W24-R80 HydrophobicContact CE3-CG 4.09Å; W24-R80 HydrophobicContact CG-CG 4.13Å; W24-R80 HydrophobicContact CZ3-CB 4.41Å; W24-R80 HydrophobicContact CZ3-CG 4.5Å; W24-L81 HydrophobicContact CH2-CB 4.07Å; W24-L81 HydrophobicContact CH2-CD1 3.74Å; W24-L81 HydrophobicContact CZ3-CB 4Å; W24-L81 HydrophobicContact CZ3-CD1 4.21Å; W24-H84 HydrophobicContact CH2-CB 4.23Å; W24-H84 HydrophobicContact CZ2-CB 3.91Å; W24-H84 AromaticContact CZ2-CD2 3.8Å; W24-H84 AromaticContact CZ2-CG 3.93Å
25	L	90.4	Very high	85.4	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-65.4	-31.2	174.3	-76.2	169.2	0	0	0	112.4	F21 R23 W28 R29 F43 A46 L47 L50 F69 L73	F21-L25 VanDerWaalsContact O-CB 3.32Å; F21-L25 WeakPolarHBondContact O-CB 3.41Å; F21-L25 VanDerWaalsContact O-CG 3.3Å; F21-L25 WeakPolarHBondContact O-CG 3.44Å; F21-L25 PolarHBondContact O-N 2.78Å; R23-L25 PolarHBondContact O-N 3.3Å; L25-W28 HydrophobicContact CD2-CE3 4.06Å; L25-W28 HydrophobicContact CD2-CZ3 4.27Å; L25-R29 VanDerWaalsContact O-CB 3.28Å; L25-R29 WeakPolarHBondContact O-CB 3.35Å; L25-R29 PolarHBondContact O-N 2.88Å; L25-F43 HydrophobicContact CD2-CD1 4.02Å; L25-A46 HydrophobicContact CD1-CB 4.39Å; L25-A46 HydrophobicContact CD2-CB 4.23Å; L25-L47 HydrophobicContact CB-CD1 3.71Å; L25-L50 HydrophobicContact CD1-CD2 3.7Å; L25-F69 HydrophobicContact CD1-CE1 4.14Å; L25-F69 HydrophobicContact CD1-CZ 3.74Å; L25-L73 HydrophobicContact CD2-CD1 3.87Å; L25-L73 HydrophobicContact CD2-CD2 4.12Å; L25-L73 HydrophobicContact CD2-CG 4.4Å
26	T	89.5	Confident	86.6	Confident	31 Å²	31	51 Å²	51	19%	0.19	27%	0.272	C	S	.	.	H	α-helix	trans	-69.9	-48.3	174.6	-55.9	0	0	0	0	110.1	V22 R23 W24 W28 R29 D30 L47	V22-T26 WeakPolarHBondContact O-CB 3.34Å; V22-T26 PolarHBondContact O-N 3.29Å; V22-T26 PolarHBondContact O-OG1 3.09Å; R23-T26 WeakPolarHBondContact O-CB 3.44Å; R23-T26 PolarHBondContact O-N 2.93Å; R23-T26 VanDerWaalsContact O-N 3.1Å; W24-T26 VanDerWaalsContact C-N 3.26Å; W24-T26 PolarHBondContact O-N 2.94Å; T26-W28 PolarHBondContact O-N 3.41Å; T26-R29 WeakPolarHBondContact O-CB 3.37Å; T26-R29 PolarHBondContact O-N 3.13Å; T26-D30 PolarHBondContact O-N 3.5Å; T26-L47 WeakPolarHBondContact OG1-CD1 3.35Å
27	E	91.6	Very high	87.8	Confident	61 Å²	61	56.9 Å²	56.9	29%	0.285	29%	0.288	S	S	.	.	H	α-helix	trans	-56.1	-47.8	175.6	-69.7	166.4	-172.3	0	0	111.6	R23 W24 R29 D30 E31 R80	R23-E27 VanDerWaalsContact CG-OE1 3.22Å; R23-E27 WeakPolarHBondContact CG-OE1 3.46Å; R23-E27 IonicContact NE-OE1 3.9Å; R23-E27 PolarHBondContact NE-OE1 2.85Å; R23-E27 WeakPolarHBondContact O-CG 3.37Å; R23-E27 PolarHBondContact O-N 2.79Å; W24-E27 PolarHBondContact O-N 2.87Å; E27-R29 PolarHBondContact O-N 3.48Å; E27-D30 PolarHBondContact O-N 3.46Å; E27-E31 WeakPolarHBondContact O-CB 3.44Å; E27-E31 PolarHBondContact O-N 3.24Å; E27-R80 IonicContact OE2-CZ 2.66Å; E27-R80 IonicContact OE2-NE 3.59Å; E27-R80 IonicContact OE2-NH2 3.29Å; E27-R80 PolarHBondContact OE2-NH2 3.33Å
28	W	92.4	Very high	88.1	Confident	32 Å²	32	65.8 Å²	65.8	12%	0.121	32%	0.317	C	S	.	.	H	α-helix	trans	-68	-33.2	178.9	-65.3	-23.9	0	0	0	113.8	W24 L25 T26 A32 F43 L73 M76 L77 R80	W24-W28 WeakPolarHBondContact O-CB 3.26Å; W24-W28 VanDerWaalsContact O-CG 3.25Å; W24-W28 PolarHBondContact O-N 2.9Å; L25-W28 HydrophobicContact CD2-CE3 4.06Å; L25-W28 HydrophobicContact CD2-CZ3 4.27Å; T26-W28 PolarHBondContact O-N 3.41Å; W28-A32 VanDerWaalsContact O-CB 3.24Å; W28-A32 WeakPolarHBondContact O-CB 3.46Å; W28-A32 PolarHBondContact O-N 2.65Å; W28-F43 HydrophobicContact CB-CD1 4.25Å; W28-F43 HydrophobicContact CB-CD2 3.93Å; W28-F43 HydrophobicContact CB-CE1 4.14Å; W28-F43 HydrophobicContact CB-CE2 3.82Å; W28-F43 HydrophobicContact CB-CG 4.16Å; W28-F43 HydrophobicContact CB-CZ 3.93Å; W28-F43 HydrophobicContact CE3-CD1 4.3Å; W28-F43 AromaticContact CE3-CE1 3.98Å; W28-F43 HydrophobicContact CE3-CE1 3.98Å; W28-F43 WeakPolarHBondContact O-CD2 3.21Å; W28-L73 HydrophobicContact CE3-CD1 4.25Å; W28-L73 HydrophobicContact CZ3-CD1 3.99Å; W28-M76 HydrophobicContact CD2-CE 4.07Å; W28-M76 HydrophobicContact CE3-CE 4.16Å; W28-M76 HydrophobicContact CH2-CB 3.64Å; W28-M76 HydrophobicContact CH2-CE 4.28Å; W28-M76 WeakPolarHBondContact CH2-O 3.17Å; W28-M76 HydrophobicContact CZ2-CB 4.19Å; W28-M76 HydrophobicContact CZ2-CE 4.13Å; W28-M76 HydrophobicContact CZ3-CB 4.09Å; W28-M76 HydrophobicContact CZ3-CE 4.29Å; W28-L77 HydrophobicContact CH2-CD2 3.8Å; W28-L77 HydrophobicContact CH2-CG 4.08Å; W28-L77 HydrophobicContact CZ3-CD2 3.68Å; W28-L77 HydrophobicContact CZ3-CG 3.93Å; W28-R80 HydrophobicContact CH2-CB 4.43Å; W28-R80 HydrophobicContact CZ2-CB 4.11Å; W28-R80 HydrophobicContact CZ2-CG 4.35Å
29	R	92.9	Very high	88.1	Confident	61 Å²	61	68.4 Å²	68.4	23%	0.23	33%	0.334	C	S	.	.	H	α-helix	trans	-64.3	-45.3	172.7	179.3	-158.7	68	-164.3	-0.3	110.7	L25 T26 E27 A32 T33 F43	L25-R29 VanDerWaalsContact O-CB 3.28Å; L25-R29 WeakPolarHBondContact O-CB 3.35Å; L25-R29 PolarHBondContact O-N 2.88Å; T26-R29 WeakPolarHBondContact O-CB 3.37Å; T26-R29 PolarHBondContact O-N 3.13Å; E27-R29 PolarHBondContact O-N 3.48Å; R29-A32 PolarHBondContact O-N 2.88Å; R29-T33 WeakPolarHBondContact O-CB 3.43Å; R29-T33 PolarHBondContact O-N 2.93Å; R29-T33 PolarHBondContact O-OG1 3.23Å; R29-F43 HydrophobicContact CB-CB 3.87Å
30	D	89	Confident	88.2	Confident	55 Å²	55	69 Å²	69	29%	0.294	33%	0.325	S	S	.	.	H	α-helix	trans	-71	-38.3	-175.7	-64.2	-14.5	0	0	0	110.6	T26 E27 T33 R34	T26-D30 PolarHBondContact O-N 3.5Å; E27-D30 PolarHBondContact O-N 3.46Å; D30-T33 WeakPolarHBondContact O-CB 3.44Å; D30-T33 PolarHBondContact O-N 3.23Å; D30-R34 PolarHBondContact O-N 3.24Å
31	E	89.9	Confident	88.1	Confident	97 Å²	97	70.8 Å²	70.8	45%	0.453	33%	0.331	S	S	.	.	H	α-helix	trans	-60.2	-51.1	170	-168.1	60.1	-129	0	0	111.7	E27 T33 R34 S35	E27-E31 WeakPolarHBondContact O-CB 3.44Å; E27-E31 PolarHBondContact O-N 3.24Å; E31-T33 PolarHBondContact O-N 2.98Å; E31-R34 VanDerWaalsContact CD-NH1 3.34Å; E31-R34 PolarHBondContact O-N 2.88Å; E31-R34 VanDerWaalsContact O-N 3.14Å; E31-R34 IonicContact OE1-NH1 3.67Å; E31-R34 IonicContact OE2-CZ 2.92Å; E31-R34 IonicContact OE2-NH1 2.83Å; E31-R34 PolarHBondContact OE2-NH1 3.39Å; E31-R34 IonicContact OE2-NH2 3.74Å; E31-S35 PolarHBondContact O-N 3.33Å; E31-S35 PolarHBondContact O-OG 3.16Å; E31-S35 VanDerWaalsContact O-OG 3.11Å
32	A	87.3	Confident	88	Confident	5 Å²	5	73.9 Å²	73.9	4%	0.041	35%	0.35	C	S	.	.	H	α-helix	trans	-62.5	-26.9	177.7	0	0	0	0	0	112.7	W28 R29 G36 R37 R40 F43	W28-A32 VanDerWaalsContact O-CB 3.24Å; W28-A32 WeakPolarHBondContact O-CB 3.46Å; W28-A32 PolarHBondContact O-N 2.65Å; R29-A32 PolarHBondContact O-N 2.88Å; A32-G36 PolarHBondContact O-N 2.7Å; A32-R37 HydrophobicContact CB-CB 4.25Å; A32-R37 PolarHBondContact O-N 3.38Å; A32-R40 HydrophobicContact CB-CB 3.89Å; A32-F43 HydrophobicContact CB-CD2 4.18Å; A32-F43 HydrophobicContact CB-CE2 4.12Å
33	T	88.4	Confident	88	Confident	66 Å²	66	74 Å²	74	41%	0.405	35%	0.349	S	S	.	.	H	α-helix	trans	-73.7	-45.2	175.3	-58.2	0	0	0	0	110.9	R29 D30 E31 S35 G36	R29-T33 WeakPolarHBondContact O-CB 3.43Å; R29-T33 PolarHBondContact O-N 2.93Å; R29-T33 PolarHBondContact O-OG1 3.23Å; D30-T33 WeakPolarHBondContact O-CB 3.44Å; D30-T33 PolarHBondContact O-N 3.23Å; E31-T33 PolarHBondContact O-N 2.98Å; T33-S35 VanDerWaalsContact C-N 3.33Å; T33-S35 PolarHBondContact O-N 3.35Å; T33-G36 PolarHBondContact O-N 3.22Å
34	R	89.1	Confident	87.9	Confident	174 Å²	174	72 Å²	72	66%	0.657	35%	0.345	S	S	*	.	H	α-helix	trans	-62.6	-38	175.1	-75.5	-174.2	-105	105.6	-1.5	112.4	D30 E31 G36	D30-R34 PolarHBondContact O-N 3.24Å; E31-R34 VanDerWaalsContact CD-NH1 3.34Å; E31-R34 PolarHBondContact O-N 2.88Å; E31-R34 VanDerWaalsContact O-N 3.14Å; E31-R34 IonicContact OE1-NH1 3.67Å; E31-R34 IonicContact OE2-CZ 2.92Å; E31-R34 IonicContact OE2-NH1 2.83Å; E31-R34 PolarHBondContact OE2-NH1 3.39Å; E31-R34 IonicContact OE2-NH2 3.74Å; R34-G36 VanDerWaalsContact C-N 3.33Å; R34-G36 PolarHBondContact O-N 3.26Å
35	S	84.5	Confident	87.6	Confident	57 Å²	57	77.2 Å²	77.2	40%	0.399	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.2	5.2	177.1	-42.5	0	0	0	0	114.9	E31 T33 R37	E31-S35 PolarHBondContact O-N 3.33Å; E31-S35 PolarHBondContact O-OG 3.16Å; E31-S35 VanDerWaalsContact O-OG 3.11Å; T33-S35 VanDerWaalsContact C-N 3.33Å; T33-S35 PolarHBondContact O-N 3.35Å; S35-R37 PolarHBondContact O-N 3.06Å; S35-R37 VanDerWaalsContact O-N 3.16Å
36	G	83.1	Confident	87.5	Confident	63 Å²	63	77.2 Å²	77.2	65%	0.649	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.7	17.1	-179.7	0	0	0	0	0	115.5	A32 T33 R34	A32-G36 PolarHBondContact O-N 2.7Å; T33-G36 PolarHBondContact O-N 3.22Å; R34-G36 VanDerWaalsContact C-N 3.33Å; R34-G36 PolarHBondContact O-N 3.26Å
37	R	88.5	Confident	87.4	Confident	165 Å²	165	76 Å²	76	62%	0.623	36%	0.36	S	S	*	.			trans	-80.8	137.9	-175.1	-67.3	178.3	-178.5	-177.2	1.4	111.6	A32 S35 T39 R40	A32-R37 HydrophobicContact CB-CB 4.25Å; A32-R37 PolarHBondContact O-N 3.38Å; S35-R37 PolarHBondContact O-N 3.06Å; S35-R37 VanDerWaalsContact O-N 3.16Å; R37-T39 PolarHBondContact O-N 2.94Å; R37-T39 VanDerWaalsContact O-N 3.1Å; R37-R40 WeakPolarHBondContact O-CG 3.28Å; R37-R40 PolarHBondContact O-N 2.61Å
38	R	80.7	Confident	87.1	Confident	220 Å²	220	80.3 Å²	80.3	83%	0.83	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-17	175.4	-72.1	-174.1	168.4	-175.6	-2.9	113.8	R40 F41	R38-R40 PolarHBondContact O-N 3.04Å; R38-R40 VanDerWaalsContact O-N 3.17Å; R38-F41 WeakPolarHBondContact O-CD2 3.33Å; R38-F41 PolarHBondContact O-N 3.14Å
39	T	83.2	Confident	86.7	Confident	63 Å²	63	79.8 Å²	79.8	39%	0.387	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-18.1	176	52.3	0	0	0	0	113.5	R37 F41 V42 F43	R37-T39 PolarHBondContact O-N 2.94Å; R37-T39 VanDerWaalsContact O-N 3.1Å; T39-F41 PolarHBondContact O-N 3.34Å; T39-V42 WeakPolarHBondContact O-CB 3.42Å; T39-V42 PolarHBondContact O-N 2.69Å; T39-F43 VanDerWaalsContact O-CD2 3.25Å; T39-F43 WeakPolarHBondContact O-CD2 3.47Å; T39-F43 PolarHBondContact O-N 3.27Å; T39-F43 VanDerWaalsContact O-N 3.1Å
40	R	86.2	Confident	86.3	Confident	94 Å²	94	77 Å²	77	36%	0.355	36%	0.364	S	S	.	.	H	α-helix	trans	-52.1	-38.5	172.1	74.6	-177.2	-175.2	177.6	-2.7	112.9	A32 R37 R38 V42 Q44	A32-R40 HydrophobicContact CB-CB 3.89Å; R37-R40 WeakPolarHBondContact O-CG 3.28Å; R37-R40 PolarHBondContact O-N 2.61Å; R38-R40 PolarHBondContact O-N 3.04Å; R38-R40 VanDerWaalsContact O-N 3.17Å; R40-V42 VanDerWaalsContact C-N 3.33Å; R40-Q44 VanDerWaalsContact O-CB 3.32Å; R40-Q44 WeakPolarHBondContact O-CB 3.46Å; R40-Q44 PolarHBondContact O-N 2.91Å
41	F	85.1	Confident	86	Confident	98 Å²	98	81.8 Å²	81.8	43%	0.43	38%	0.378	S	S	.	.	H	α-helix	trans	-72	-30.2	-179.3	-62.8	-68.7	0	0	0	112.1	R38 T39 K45	R38-F41 WeakPolarHBondContact O-CD2 3.33Å; R38-F41 PolarHBondContact O-N 3.14Å; T39-F41 PolarHBondContact O-N 3.34Å; F41-K45 WeakPolarHBondContact O-CB 3.45Å; F41-K45 VanDerWaalsContact O-CG 3.26Å; F41-K45 WeakPolarHBondContact O-CG 3.41Å; F41-K45 PolarHBondContact O-N 3.27Å; F41-K45 VanDerWaalsContact O-N 3.12Å
42	V	85.9	Confident	85.5	Confident	74 Å²	74	87.5 Å²	87.5	45%	0.448	40%	0.396	S	S	.	.	H	α-helix	trans	-70	-49.8	176.2	-178.4	0	0	0	0	109.5	T39 R40 Q44 K45 A46	T39-V42 WeakPolarHBondContact O-CB 3.42Å; T39-V42 PolarHBondContact O-N 2.69Å; R40-V42 VanDerWaalsContact C-N 3.33Å; V42-Q44 VanDerWaalsContact C-N 3.34Å; V42-Q44 PolarHBondContact O-N 3.05Å; V42-K45 PolarHBondContact O-N 3.02Å; V42-A46 WeakPolarHBondContact O-CB 3.41Å; V42-A46 PolarHBondContact O-N 2.76Å
43	F	88.3	Confident	85.1	Confident	20 Å²	20	89.1 Å²	89.1	9%	0.088	40%	0.401	C	S	.	.	H	α-helix	trans	-62.7	-39.4	177.2	-58	-50	0	0	0	112.3	L25 W28 R29 A32 T39 K45 A46 L47 L73 M76	L25-F43 HydrophobicContact CD2-CD1 4.02Å; W28-F43 HydrophobicContact CB-CD1 4.25Å; W28-F43 HydrophobicContact CB-CD2 3.93Å; W28-F43 HydrophobicContact CB-CE1 4.14Å; W28-F43 HydrophobicContact CB-CE2 3.82Å; W28-F43 HydrophobicContact CB-CG 4.16Å; W28-F43 HydrophobicContact CB-CZ 3.93Å; W28-F43 HydrophobicContact CE3-CD1 4.3Å; W28-F43 AromaticContact CE3-CE1 3.98Å; W28-F43 HydrophobicContact CE3-CE1 3.98Å; W28-F43 WeakPolarHBondContact O-CD2 3.21Å; R29-F43 HydrophobicContact CB-CB 3.87Å; A32-F43 HydrophobicContact CB-CD2 4.18Å; A32-F43 HydrophobicContact CB-CE2 4.12Å; T39-F43 VanDerWaalsContact O-CD2 3.25Å; T39-F43 WeakPolarHBondContact O-CD2 3.47Å; T39-F43 PolarHBondContact O-N 3.27Å; T39-F43 VanDerWaalsContact O-N 3.1Å; F43-K45 PolarHBondContact O-N 2.96Å; F43-A46 PolarHBondContact O-N 2.84Å; F43-L47 VanDerWaalsContact O-CB 3.31Å; F43-L47 WeakPolarHBondContact O-CB 3.26Å; F43-L47 PolarHBondContact O-N 2.85Å; F43-L73 HydrophobicContact CD1-CD1 3.8Å; F43-L73 HydrophobicContact CE1-CD1 3.56Å; F43-M76 HydrophobicContact CE1-CE 4.38Å; F43-M76 HydrophobicContact CZ-CE 4.21Å
44	Q	88.2	Confident	84.1	Confident	72 Å²	72	89.9 Å²	89.9	34%	0.336	41%	0.407	S	S	.	.	H	α-helix	trans	-63.6	-40.6	176.7	-171.2	-179.2	15.9	0	0	112.6	R40 V42 R48	R40-Q44 VanDerWaalsContact O-CB 3.32Å; R40-Q44 WeakPolarHBondContact O-CB 3.46Å; R40-Q44 PolarHBondContact O-N 2.91Å; V42-Q44 VanDerWaalsContact C-N 3.34Å; V42-Q44 PolarHBondContact O-N 3.05Å; Q44-R48 WeakPolarHBondContact O-CG 3.49Å; Q44-R48 PolarHBondContact O-N 2.92Å
45	K	86.3	Confident	83.5	Confident	114 Å²	114	85.4 Å²	85.4	50%	0.496	40%	0.396	S	S	.	.	H	α-helix	trans	-68.1	-43.7	175.9	-75.7	178.4	-179.1	-177.9	0	111.6	F41 V42 F43 L47 R48 S49 H68	F41-K45 WeakPolarHBondContact O-CB 3.45Å; F41-K45 VanDerWaalsContact O-CG 3.26Å; F41-K45 WeakPolarHBondContact O-CG 3.41Å; F41-K45 PolarHBondContact O-N 3.27Å; F41-K45 VanDerWaalsContact O-N 3.12Å; V42-K45 PolarHBondContact O-N 3.02Å; F43-K45 PolarHBondContact O-N 2.96Å; K45-L47 VanDerWaalsContact C-N 3.34Å; K45-L47 PolarHBondContact O-N 2.79Å; K45-R48 PolarHBondContact O-N 3.01Å; K45-S49 PolarHBondContact O-N 2.98Å; K45-S49 VanDerWaalsContact O-N 3.15Å; K45-H68 HydrophobicContact CB-CB 4.07Å
46	A	87.8	Confident	83.3	Confident	0 Å²	0	86.5 Å²	86.5	0%	0	40%	0.401	C	S	.	.	H	α-helix	trans	-60.6	-41.6	174.9	0	0	0	0	0	112.1	L25 V42 F43 R48 S49 L50 F69 L73	L25-A46 HydrophobicContact CD1-CB 4.39Å; L25-A46 HydrophobicContact CD2-CB 4.23Å; V42-A46 WeakPolarHBondContact O-CB 3.41Å; V42-A46 PolarHBondContact O-N 2.76Å; F43-A46 PolarHBondContact O-N 2.84Å; A46-R48 PolarHBondContact O-N 3.05Å; A46-S49 WeakPolarHBondContact O-CB 3.34Å; A46-S49 PolarHBondContact O-N 3.26Å; A46-L50 WeakPolarHBondContact O-CB 3.47Å; A46-L50 PolarHBondContact O-N 2.86Å; A46-F69 HydrophobicContact CB-CD2 4.12Å; A46-F69 HydrophobicContact CB-CE2 3.69Å; A46-F69 HydrophobicContact CB-CZ 3.98Å; A46-F69 WeakPolarHBondContact O-CE2 3.36Å; A46-L73 HydrophobicContact CB-CD2 3.58Å
47	L	87	Confident	83.4	Confident	5 Å²	5	84.3 Å²	84.3	3%	0.026	38%	0.375	C	S	.	.	H	α-helix	trans	-60.7	-42	176.8	-165.5	90.5	0	0	0	112.5	V22 L25 T26 F43 K45 S49 R51	V22-L47 HydrophobicContact CG1-CD1 4.19Å; V22-L47 WeakPolarHBondContact O-CD1 3.38Å; L25-L47 HydrophobicContact CB-CD1 3.71Å; T26-L47 WeakPolarHBondContact OG1-CD1 3.35Å; F43-L47 VanDerWaalsContact O-CB 3.31Å; F43-L47 WeakPolarHBondContact O-CB 3.26Å; F43-L47 PolarHBondContact O-N 2.85Å; K45-L47 VanDerWaalsContact C-N 3.34Å; K45-L47 PolarHBondContact O-N 2.79Å; L47-S49 VanDerWaalsContact C-N 3.35Å; L47-R51 WeakPolarHBondContact O-CB 3.35Å; L47-R51 VanDerWaalsContact O-CG 3.31Å; L47-R51 WeakPolarHBondContact O-CG 3.34Å; L47-R51 PolarHBondContact O-N 3.42Å
48	R	84.6	Confident	83	Confident	151 Å²	151	85.2 Å²	85.2	57%	0.57	38%	0.378	S	S	*	.	H	α-helix	trans	-64.4	-40.5	176.4	-72	-179.6	-170.3	-178.8	3.6	111.7	Q44 K45 A46 R52	Q44-R48 WeakPolarHBondContact O-CG 3.49Å; Q44-R48 PolarHBondContact O-N 2.92Å; K45-R48 PolarHBondContact O-N 3.01Å; A46-R48 PolarHBondContact O-N 3.05Å; R48-R52 WeakPolarHBondContact O-CG 3.31Å; R48-R52 PolarHBondContact O-N 2.8Å
49	S	84.8	Confident	83.3	Confident	22 Å²	22	75.8 Å²	75.8	15%	0.154	35%	0.346	C	S	.	.	H	α-helix	trans	-64.2	-48	177.2	-169.2	0	0	0	0	111.3	K45 A46 L47 R51 R52 Y53 Q67	K45-S49 PolarHBondContact O-N 2.98Å; K45-S49 VanDerWaalsContact O-N 3.15Å; A46-S49 WeakPolarHBondContact O-CB 3.34Å; A46-S49 PolarHBondContact O-N 3.26Å; L47-S49 VanDerWaalsContact C-N 3.35Å; S49-R51 PolarHBondContact O-N 2.89Å; S49-R52 PolarHBondContact O-N 3.22Å; S49-Y53 PolarHBondContact O-N 2.85Å; S49-Q67 WeakPolarHBondContact CB-O 3.33Å; S49-Q67 PolarHBondContact OG-N 3.29Å; S49-Q67 VanDerWaalsContact OG-N 3.1Å; S49-Q67 PolarHBondContact OG-O 2.99Å
50	L	85.6	Confident	83.3	Confident	2 Å²	2	72.8 Å²	72.8	1%	0.01	33%	0.328	C	S	.	.	H	α-helix	trans	-63.7	-38.8	179.3	-174.8	65	0	0	0	113.4	N18 F21 V22 L25 A46 R52 Y53 L57 L66 F69	N18-L50 HydrophobicContact CB-CD1 3.85Å; N18-L50 HydrophobicContact CB-CD2 4.37Å; N18-L50 HydrophobicContact CB-CG 4.2Å; F21-L50 HydrophobicContact CB-CD2 3.56Å; V22-L50 HydrophobicContact CG2-CD2 3.61Å; V22-L50 HydrophobicContact CG2-CG 4.05Å; L25-L50 HydrophobicContact CD1-CD2 3.7Å; A46-L50 WeakPolarHBondContact O-CB 3.47Å; A46-L50 PolarHBondContact O-N 2.86Å; L50-R52 PolarHBondContact O-N 2.85Å; L50-Y53 PolarHBondContact O-N 3.24Å; L50-Y53 VanDerWaalsContact O-N 3.16Å; L50-L57 HydrophobicContact CD1-CD1 3.62Å; L50-L66 HydrophobicContact CB-CD1 4.13Å; L50-L66 HydrophobicContact CD1-CD1 3.43Å; L50-L66 VanDerWaalsContact CD1-CD1 3.43Å; L50-L66 HydrophobicContact CG-CD1 4.4Å; L50-F69 HydrophobicContact CB-CE2 4.34Å; L50-F69 HydrophobicContact CB-CZ 4.05Å; L50-F69 HydrophobicContact CD1-CZ 4.46Å; L50-F69 HydrophobicContact CD2-CZ 4.46Å
51	R	81.7	Confident	83	Confident	155 Å²	155	76 Å²	76	59%	0.585	34%	0.344	S	S	*	.	H	α-helix	trans	-66.6	-22.4	177.8	-76.6	177.1	177.7	-176.5	-1.9	113.8	V22 L47 S49	V22-R51 HydrophobicContact CG2-CG 4.43Å; L47-R51 WeakPolarHBondContact O-CB 3.35Å; L47-R51 VanDerWaalsContact O-CG 3.31Å; L47-R51 WeakPolarHBondContact O-CG 3.34Å; L47-R51 PolarHBondContact O-N 3.42Å; S49-R51 PolarHBondContact O-N 2.89Å
52	R	79.1	Confident	82.8	Confident	217 Å²	217	75 Å²	75	82%	0.819	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.6	-11	176.7	-69.8	175.7	175.9	-174.8	-2.6	112.5	R48 S49 L50	R48-R52 WeakPolarHBondContact O-CG 3.31Å; R48-R52 PolarHBondContact O-N 2.8Å; S49-R52 PolarHBondContact O-N 3.22Å; L50-R52 PolarHBondContact O-N 2.85Å
53	Y	79.1	Confident	82.7	Confident	39 Å²	39	71.5 Å²	71.5	15%	0.153	32%	0.32	C	S	.	.			trans	-86.6	121.6	-176.3	-170.3	-114.1	0	0	0	111.6	S49 L50 L55 L57 I65 L66	S49-Y53 PolarHBondContact O-N 2.85Å; L50-Y53 PolarHBondContact O-N 3.24Å; L50-Y53 VanDerWaalsContact O-N 3.16Å; Y53-L55 HydrophobicContact CD1-CB 4.36Å; Y53-L55 WeakPolarHBondContact CD1-O 3.34Å; Y53-L55 HydrophobicContact CE1-CB 3.62Å; Y53-L55 WeakPolarHBondContact CE1-O 3.39Å; Y53-L57 HydrophobicContact CD1-CD1 4.45Å; Y53-L57 HydrophobicContact CD1-CD2 4.15Å; Y53-L57 HydrophobicContact CD1-CG 4.17Å; Y53-L57 HydrophobicContact CE1-CD2 3.52Å; Y53-L57 HydrophobicContact CE1-CG 3.96Å; Y53-I65 HydrophobicContact CE1-CD1 4.12Å; Y53-I65 HydrophobicContact CE2-CD1 3.94Å; Y53-I65 VanDerWaalsContact CZ-CD1 3.49Å; Y53-I65 WeakPolarHBondContact OH-CD1 3.19Å; Y53-L66 HydrophobicContact CD1-CD2 4.07Å; Y53-L66 HydrophobicContact CD2-CD2 3.42Å; Y53-L66 VanDerWaalsContact CD2-CD2 3.42Å; Y53-L66 HydrophobicContact CE2-CD2 4.08Å; Y53-L66 HydrophobicContact CG-CD2 3.43Å; Y53-L66 VanDerWaalsContact CG-CD2 3.43Å
54	P	67.2	Low	82.4	Confident	83 Å²	83	76.1 Å²	76.1	54%	0.539	34%	0.34	S	S	.	.			trans	-86.5	-5.5	-169.2	33.1	-35.4	0	0	0	114.8	P17	P17-P54 VanDerWaalsContact CG-O 3.3Å; P17-P54 WeakPolarHBondContact CG-O 3.38Å
55	L	77.6	Confident	81.9	Confident	80 Å²	80	75.2 Å²	75.2	42%	0.419	34%	0.337	S	S	.	.	S	Bend	trans	-110.9	147.9	-175.8	-60.1	176.3	0	0	0	112	N18 Y53	N18-L55 PolarHBondContact ND2-O 2.96Å; Y53-L55 HydrophobicContact CD1-CB 4.36Å; Y53-L55 WeakPolarHBondContact CD1-O 3.34Å; Y53-L55 HydrophobicContact CE1-CB 3.62Å; Y53-L55 WeakPolarHBondContact CE1-O 3.39Å
56	P	80.5	Confident	81.5	Confident	79 Å²	79	70.4 Å²	70.4	51%	0.513	32%	0.316	S	S	.	.			trans	-70.4	138.6	173.5	29.8	-33.9	0	0	0	111	N18	N18-P56 WeakPolarHBondContact OD1-CA 3.41Å
57	L	84.8	Confident	81	Confident	17 Å²	17	76.4 Å²	76.4	9%	0.089	34%	0.344	C	S	.	.			trans	-103.4	133	174.5	-60.8	172	0	0	0	108.6	N18 F21 L50 Y53 E62 A63 I65 L66	N18-L57 WeakPolarHBondContact OD1-CB 3.35Å; N18-L57 PolarHBondContact OD1-N 3.38Å; F21-L57 HydrophobicContact CD2-CB 4.3Å; F21-L57 HydrophobicContact CD2-CD1 4.22Å; F21-L57 HydrophobicContact CE2-CB 3.91Å; F21-L57 HydrophobicContact CE2-CD1 4.37Å; L50-L57 HydrophobicContact CD1-CD1 3.62Å; Y53-L57 HydrophobicContact CD1-CD1 4.45Å; Y53-L57 HydrophobicContact CD1-CD2 4.15Å; Y53-L57 HydrophobicContact CD1-CG 4.17Å; Y53-L57 HydrophobicContact CE1-CD2 3.52Å; Y53-L57 HydrophobicContact CE1-CG 3.96Å; L57-E62 HydrophobicContact CD2-CB 3.91Å; L57-A63 HydrophobicContact CD1-CB 3.8Å; L57-I65 HydrophobicContact CD2-CD1 3.89Å; L57-L66 HydrophobicContact CD1-CD1 3.72Å; L57-L66 HydrophobicContact CD1-CG 4.48Å
58	R	79.9	Confident	81	Confident	184 Å²	184	80.8 Å²	80.8	69%	0.694	37%	0.365	S	S	*	.	S	Bend	trans	-100.9	-7.7	-177.3	-58.3	178.1	175	-89.9	1.2	113.2	E62 L81 R85	R58-E62 PolarHBondContact N-OE2 3.02Å; R58-L81 VanDerWaalsContact O-CD2 3.27Å; R58-L81 WeakPolarHBondContact O-CD2 3.37Å; R58-R85 PolarHBondContact O-NH2 3.33Å
59	S	86.8	Confident	81	Confident	23 Å²	23	74.2 Å²	74.2	16%	0.161	34%	0.34	C	S	.	.	S	Bend	trans	-153.6	158.8	179.8	61.6	0	0	0	0	112.2	F21 K61 E62 A63 D78	F21-S59 WeakPolarHBondContact CE2-O 3.44Å; S59-K61 VanDerWaalsContact C-N 3.27Å; S59-E62 PolarHBondContact O-N 3.34Å; S59-E62 WeakPolarHBondContact OG-CG 3.44Å; S59-E62 PolarHBondContact OG-N 2.93Å; S59-E62 VanDerWaalsContact OG-N 3.12Å; S59-E62 PolarHBondContact OG-OE1 3.14Å; S59-A63 PolarHBondContact O-N 2.67Å; S59-D78 WeakPolarHBondContact CB-OD1 3.44Å
60	G	82.3	Confident	80.9	Confident	0 Å²	0	75.1 Å²	75.1	0%	0	35%	0.353	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-33.7	168	0	0	0	0	0	112.3	E62 A63 C74 D78	G60-E62 PolarHBondContact O-N 2.82Å; G60-A63 VanDerWaalsContact O-CB 3.3Å; G60-A63 WeakPolarHBondContact O-CB 3.47Å; G60-A63 PolarHBondContact O-N 3.37Å; G60-A63 VanDerWaalsContact O-N 3.11Å; G60-C74 WeakPolarHBondContact CA-O 3.48Å; G60-C74 VanDerWaalsContact O-CB 3.25Å; G60-C74 WeakPolarHBondContact O-CB 3.3Å; G60-C74 PolarHBondContact O-SG 2.84Å; G60-D78 WeakPolarHBondContact CA-OD1 3.43Å; G60-D78 PolarHBondContact N-OD1 3.35Å
61	K	81.2	Confident	80.6	Confident	161 Å²	161	79.3 Å²	79.3	70%	0.7	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	-45.3	170.1	-71.5	178.2	-172.7	176.8	0	112.9	S59 A63 K64 D78	S59-K61 VanDerWaalsContact C-N 3.27Å; K61-A63 PolarHBondContact O-N 3.48Å; K61-K64 WeakPolarHBondContact O-CB 3.34Å; K61-K64 PolarHBondContact O-N 3.15Å; K61-K64 VanDerWaalsContact O-N 3.14Å; K61-D78 PolarHBondContact N-OD2 3.38Å
62	E	79.9	Confident	80.5	Confident	77 Å²	77	74.3 Å²	74.3	36%	0.36	37%	0.372	S	S	.	.	G	3₁₀ helix	trans	-64.5	-30.4	175.6	-76.1	165.4	-135.7	0	0	112	L57 R58 S59 G60 K64 I65	L57-E62 HydrophobicContact CD2-CB 3.91Å; R58-E62 PolarHBondContact N-OE2 3.02Å; S59-E62 PolarHBondContact O-N 3.34Å; S59-E62 WeakPolarHBondContact OG-CG 3.44Å; S59-E62 PolarHBondContact OG-N 2.93Å; S59-E62 VanDerWaalsContact OG-N 3.12Å; S59-E62 PolarHBondContact OG-OE1 3.14Å; G60-E62 PolarHBondContact O-N 2.82Å; E62-K64 PolarHBondContact O-N 2.66Å; E62-K64 VanDerWaalsContact O-N 3.13Å; E62-I65 WeakPolarHBondContact O-CD1 3.39Å; E62-I65 WeakPolarHBondContact O-CG1 3.43Å; E62-I65 PolarHBondContact O-N 3.26Å
63	A	83.5	Confident	81	Confident	0 Å²	0	64.6 Å²	64.6	0%	0	34%	0.336	C	S	.	.	G	3₁₀ helix	trans	-65.7	-13.5	176.6	0	0	0	0	0	113.4	F21 L57 S59 G60 K61 I65 L66 F69 L77	F21-A63 HydrophobicContact CE2-CB 4.39Å; L57-A63 HydrophobicContact CD1-CB 3.8Å; S59-A63 PolarHBondContact O-N 2.67Å; G60-A63 VanDerWaalsContact O-CB 3.3Å; G60-A63 WeakPolarHBondContact O-CB 3.47Å; G60-A63 PolarHBondContact O-N 3.37Å; G60-A63 VanDerWaalsContact O-N 3.11Å; K61-A63 PolarHBondContact O-N 3.48Å; A63-I65 PolarHBondContact O-N 3.04Å; A63-L66 VanDerWaalsContact O-CB 3.28Å; A63-L66 WeakPolarHBondContact O-CB 3.36Å; A63-L66 PolarHBondContact O-N 2.92Å; A63-F69 HydrophobicContact CB-CD1 3.45Å; A63-F69 VanDerWaalsContact CB-CD1 3.45Å; A63-F69 HydrophobicContact CB-CE1 3.65Å; A63-F69 HydrophobicContact CB-CG 4.2Å; A63-F69 WeakPolarHBondContact O-CB 3.25Å; A63-F69 VanDerWaalsContact O-CG 3.28Å; A63-F69 WeakPolarHBondContact O-CG 3.46Å; A63-L77 HydrophobicContact CB-CD1 4.38Å
64	K	82.9	Confident	81.4	Confident	117 Å²	117	63 Å²	63	51%	0.509	33%	0.33	S	S	.	.	G	3₁₀ helix	trans	-62.1	-21.3	176.2	-167.1	166.9	179.3	170.9	0	113.4	K61 E62 L66 D71	K61-K64 WeakPolarHBondContact O-CB 3.34Å; K61-K64 PolarHBondContact O-N 3.15Å; K61-K64 VanDerWaalsContact O-N 3.14Å; E62-K64 PolarHBondContact O-N 2.66Å; E62-K64 VanDerWaalsContact O-N 3.13Å; K64-L66 PolarHBondContact O-N 2.88Å; K64-D71 WeakPolarHBondContact CE-OD1 3.23Å; K64-D71 IonicContact NZ-OD1 3.89Å; K64-D71 PolarHBondContact NZ-OD1 3.38Å; K64-D71 IonicContact NZ-OD2 3.63Å
65	I	76.6	Confident	82.5	Confident	53 Å²	53	67.1 Å²	67.1	27%	0.272	34%	0.336	S	S	.	.	G	3₁₀ helix	trans	-66.3	-19.1	173	71.6	-166.6	0	0	0	112.6	Y53 L57 E62 A63	Y53-I65 HydrophobicContact CE1-CD1 4.12Å; Y53-I65 HydrophobicContact CE2-CD1 3.94Å; Y53-I65 VanDerWaalsContact CZ-CD1 3.49Å; Y53-I65 WeakPolarHBondContact OH-CD1 3.19Å; L57-I65 HydrophobicContact CD2-CD1 3.89Å; E62-I65 WeakPolarHBondContact O-CD1 3.39Å; E62-I65 WeakPolarHBondContact O-CG1 3.43Å; E62-I65 PolarHBondContact O-N 3.26Å; A63-I65 PolarHBondContact O-N 3.04Å
66	L	79.1	Confident	83	Confident	14 Å²	14	66.8 Å²	66.8	7%	0.073	33%	0.333	C	S	.	.	S	Bend	trans	-88.1	141.7	-177.7	-58.2	-177.8	0	0	0	111.3	L50 Y53 L57 A63 K64 H68 F69	L50-L66 HydrophobicContact CB-CD1 4.13Å; L50-L66 HydrophobicContact CD1-CD1 3.43Å; L50-L66 VanDerWaalsContact CD1-CD1 3.43Å; L50-L66 HydrophobicContact CG-CD1 4.4Å; Y53-L66 HydrophobicContact CD1-CD2 4.07Å; Y53-L66 HydrophobicContact CD2-CD2 3.42Å; Y53-L66 VanDerWaalsContact CD2-CD2 3.42Å; Y53-L66 HydrophobicContact CE2-CD2 4.08Å; Y53-L66 HydrophobicContact CG-CD2 3.43Å; Y53-L66 VanDerWaalsContact CG-CD2 3.43Å; L57-L66 HydrophobicContact CD1-CD1 3.72Å; L57-L66 HydrophobicContact CD1-CG 4.48Å; A63-L66 VanDerWaalsContact O-CB 3.28Å; A63-L66 WeakPolarHBondContact O-CB 3.36Å; A63-L66 PolarHBondContact O-N 2.92Å; K64-L66 PolarHBondContact O-N 2.88Å; L66-H68 PolarHBondContact O-N 2.9Å; L66-F69 HydrophobicContact CB-CD2 3.45Å; L66-F69 VanDerWaalsContact CB-CD2 3.45Å; L66-F69 HydrophobicContact CB-CE2 3.74Å; L66-F69 HydrophobicContact CB-CG 4.17Å; L66-F69 HydrophobicContact CD1-CD2 4.25Å; L66-F69 HydrophobicContact CD1-CE2 3.77Å; L66-F69 HydrophobicContact CD1-CZ 4.01Å; L66-F69 HydrophobicContact CG-CD2 4.46Å; L66-F69 HydrophobicContact CG-CE2 4.42Å; L66-F69 PolarHBondContact O-N 2.69Å
67	Q	77.3	Confident	83.5	Confident	126 Å²	126	63 Å²	63	59%	0.589	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.8	138.1	173.6	-64.9	-175.9	3.5	0	0	110.5	S49 F69	S49-Q67 WeakPolarHBondContact CB-O 3.33Å; S49-Q67 PolarHBondContact OG-N 3.29Å; S49-Q67 VanDerWaalsContact OG-N 3.1Å; S49-Q67 PolarHBondContact OG-O 2.99Å; Q67-F69 VanDerWaalsContact C-N 3.33Å
68	H	85.9	Confident	83.7	Confident	97 Å²	97	64.2 Å²	64.2	45%	0.449	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.5	14.9	179.6	-43.9	-62.4	0	0	0	116	K45 L66	K45-H68 HydrophobicContact CB-CB 4.07Å; L66-H68 PolarHBondContact O-N 2.9Å
69	F	86	Confident	84.1	Confident	12 Å²	12	60 Å²	60	5%	0.053	30%	0.303	C	S	.	.			trans	-100.7	94.7	167.4	-74.5	-108	0	0	0	110.2	L25 A46 L50 A63 L66 Q67 L73 L77	L25-F69 HydrophobicContact CD1-CE1 4.14Å; L25-F69 HydrophobicContact CD1-CZ 3.74Å; A46-F69 HydrophobicContact CB-CD2 4.12Å; A46-F69 HydrophobicContact CB-CE2 3.69Å; A46-F69 HydrophobicContact CB-CZ 3.98Å; A46-F69 WeakPolarHBondContact O-CE2 3.36Å; L50-F69 HydrophobicContact CB-CE2 4.34Å; L50-F69 HydrophobicContact CB-CZ 4.05Å; L50-F69 HydrophobicContact CD1-CZ 4.46Å; L50-F69 HydrophobicContact CD2-CZ 4.46Å; A63-F69 HydrophobicContact CB-CD1 3.45Å; A63-F69 VanDerWaalsContact CB-CD1 3.45Å; A63-F69 HydrophobicContact CB-CE1 3.65Å; A63-F69 HydrophobicContact CB-CG 4.2Å; A63-F69 WeakPolarHBondContact O-CB 3.25Å; A63-F69 VanDerWaalsContact O-CG 3.28Å; A63-F69 WeakPolarHBondContact O-CG 3.46Å; L66-F69 HydrophobicContact CB-CD2 3.45Å; L66-F69 VanDerWaalsContact CB-CD2 3.45Å; L66-F69 HydrophobicContact CB-CE2 3.74Å; L66-F69 HydrophobicContact CB-CG 4.17Å; L66-F69 HydrophobicContact CD1-CD2 4.25Å; L66-F69 HydrophobicContact CD1-CE2 3.77Å; L66-F69 HydrophobicContact CD1-CZ 4.01Å; L66-F69 HydrophobicContact CG-CD2 4.46Å; L66-F69 HydrophobicContact CG-CE2 4.42Å; L66-F69 PolarHBondContact O-N 2.69Å; Q67-F69 VanDerWaalsContact C-N 3.33Å; F69-L73 HydrophobicContact CD1-CD2 3.88Å; F69-L73 HydrophobicContact CD1-CG 4.23Å; F69-L73 HydrophobicContact CE1-CD2 4.18Å; F69-L73 HydrophobicContact CG-CD2 4.15Å; F69-L77 HydrophobicContact CD1-CD1 3.89Å; F69-L77 HydrophobicContact CE1-CD1 3.48Å; F69-L77 VanDerWaalsContact CE1-CD1 3.48Å
70	G	81.3	Confident	84.2	Confident	42 Å²	42	62.8 Å²	62.8	43%	0.433	31%	0.31	S	S	.	.			trans	-87.5	169.5	171.8	0	0	0	0	0	112.3	G72 L73 C74	G70-G72 PolarHBondContact O-N 2.99Å; G70-G72 VanDerWaalsContact O-N 3.13Å; G70-L73 PolarHBondContact O-N 3.04Å; G70-C74 PolarHBondContact O-N 2.9Å; G70-C74 PolarHBondContact O-SG 3.4Å
71	D	79.5	Confident	84.5	Confident	90 Å²	90	63.5 Å²	63.5	48%	0.481	31%	0.313	S	S	.	.	H	α-helix	trans	-53.9	-38.2	-175.1	-67.9	-43.6	0	0	0	113.7	K64 R75	K64-D71 WeakPolarHBondContact CE-OD1 3.23Å; K64-D71 IonicContact NZ-OD1 3.89Å; K64-D71 PolarHBondContact NZ-OD1 3.38Å; K64-D71 IonicContact NZ-OD2 3.63Å; D71-R75 WeakPolarHBondContact O-CB 3.3Å; D71-R75 VanDerWaalsContact O-CG 3.28Å; D71-R75 WeakPolarHBondContact O-CG 3.42Å; D71-R75 PolarHBondContact O-N 2.97Å
72	G	80.9	Confident	84.8	Confident	49 Å²	49	62.1 Å²	62.1	51%	0.505	31%	0.309	S	S	.	.	H	α-helix	trans	-63.7	-42.2	176	0	0	0	0	0	113.1	G70 R75 M76	G70-G72 PolarHBondContact O-N 2.99Å; G70-G72 VanDerWaalsContact O-N 3.13Å; G72-R75 PolarHBondContact O-N 3.14Å; G72-M76 VanDerWaalsContact O-CG 3.27Å; G72-M76 WeakPolarHBondContact O-CG 2.96Å; G72-M76 PolarHBondContact O-N 3.38Å
73	L	88	Confident	85	Confident	13 Å²	13	66 Å²	66	7%	0.068	32%	0.321	C	S	.	.	H	α-helix	trans	-71.5	-38.8	179.8	-172.7	61	0	0	0	111.7	L25 W28 F43 A46 F69 G70 M76 L77	L25-L73 HydrophobicContact CD2-CD1 3.87Å; L25-L73 HydrophobicContact CD2-CD2 4.12Å; L25-L73 HydrophobicContact CD2-CG 4.4Å; W28-L73 HydrophobicContact CE3-CD1 4.25Å; W28-L73 HydrophobicContact CZ3-CD1 3.99Å; F43-L73 HydrophobicContact CD1-CD1 3.8Å; F43-L73 HydrophobicContact CE1-CD1 3.56Å; A46-L73 HydrophobicContact CB-CD2 3.58Å; F69-L73 HydrophobicContact CD1-CD2 3.88Å; F69-L73 HydrophobicContact CD1-CG 4.23Å; F69-L73 HydrophobicContact CE1-CD2 4.18Å; F69-L73 HydrophobicContact CG-CD2 4.15Å; G70-L73 PolarHBondContact O-N 3.04Å; L73-M76 PolarHBondContact O-N 2.9Å; L73-L77 HydrophobicContact CG-CD1 4.43Å; L73-L77 WeakPolarHBondContact O-CG 3.29Å; L73-L77 PolarHBondContact O-N 3.34Å
74	C	88.6	Confident	85.1	Confident	5 Å²	5	68 Å²	68	3%	0.034	33%	0.33	C	S	.	.	H	α-helix	trans	-60.2	-46.5	174.3	-67.6	0	0	0	0	111.3	G60 G70 L77 D78	G60-C74 WeakPolarHBondContact CA-O 3.48Å; G60-C74 VanDerWaalsContact O-CB 3.25Å; G60-C74 WeakPolarHBondContact O-CB 3.3Å; G60-C74 PolarHBondContact O-SG 2.84Å; G70-C74 PolarHBondContact O-N 2.9Å; G70-C74 PolarHBondContact O-SG 3.4Å; C74-L77 PolarHBondContact O-N 2.96Å; C74-D78 PolarHBondContact O-N 3.33Å
75	R	89.3	Confident	85.2	Confident	171 Å²	171	70.4 Å²	70.4	65%	0.645	34%	0.336	S	S	*	.	H	α-helix	trans	-60.9	-45.7	175.6	-72.9	176.7	-169.3	-175.2	2.8	112.3	D71 G72 L77 D78 E79	D71-R75 WeakPolarHBondContact O-CB 3.3Å; D71-R75 VanDerWaalsContact O-CG 3.28Å; D71-R75 WeakPolarHBondContact O-CG 3.42Å; D71-R75 PolarHBondContact O-N 2.97Å; G72-R75 PolarHBondContact O-N 3.14Å; R75-L77 VanDerWaalsContact C-N 3.25Å; R75-L77 PolarHBondContact O-N 3.14Å; R75-D78 PolarHBondContact O-N 2.7Å; R75-E79 WeakPolarHBondContact O-CG 3.48Å; R75-E79 PolarHBondContact O-N 3.06Å
76	M	88.9	Confident	85.2	Confident	73 Å²	73	73.1 Å²	73.1	36%	0.36	36%	0.356	S	S	.	.	H	α-helix	trans	-58.2	-38.3	176.6	-71.8	175.2	67.7	0	0	112.4	W28 F43 G72 L73 R80	W28-M76 HydrophobicContact CD2-CE 4.07Å; W28-M76 HydrophobicContact CE3-CE 4.16Å; W28-M76 HydrophobicContact CH2-CB 3.64Å; W28-M76 HydrophobicContact CH2-CE 4.28Å; W28-M76 WeakPolarHBondContact CH2-O 3.17Å; W28-M76 HydrophobicContact CZ2-CB 4.19Å; W28-M76 HydrophobicContact CZ2-CE 4.13Å; W28-M76 HydrophobicContact CZ3-CB 4.09Å; W28-M76 HydrophobicContact CZ3-CE 4.29Å; F43-M76 HydrophobicContact CE1-CE 4.38Å; F43-M76 HydrophobicContact CZ-CE 4.21Å; G72-M76 VanDerWaalsContact O-CG 3.27Å; G72-M76 WeakPolarHBondContact O-CG 2.96Å; G72-M76 PolarHBondContact O-N 3.38Å; L73-M76 PolarHBondContact O-N 2.9Å; M76-R80 WeakPolarHBondContact O-CB 3.33Å; M76-R80 PolarHBondContact O-N 3.21Å
77	L	90.7	Very high	85	Confident	0 Å²	0	77.2 Å²	77.2	0%	0	39%	0.385	C	S	.	.	H	α-helix	trans	-70.9	-40.5	177	-74.4	168.2	0	0	0	112.2	F21 W24 W28 A63 F69 L73 C74 R75 R80 L81	F21-L77 HydrophobicContact CB-CD2 4.43Å; F21-L77 HydrophobicContact CD1-CD2 4.23Å; F21-L77 HydrophobicContact CD2-CD1 4.34Å; F21-L77 HydrophobicContact CG-CD2 4.16Å; W24-L77 HydrophobicContact CE3-CD2 3.98Å; W28-L77 HydrophobicContact CH2-CD2 3.8Å; W28-L77 HydrophobicContact CH2-CG 4.08Å; W28-L77 HydrophobicContact CZ3-CD2 3.68Å; W28-L77 HydrophobicContact CZ3-CG 3.93Å; A63-L77 HydrophobicContact CB-CD1 4.38Å; F69-L77 HydrophobicContact CD1-CD1 3.89Å; F69-L77 HydrophobicContact CE1-CD1 3.48Å; F69-L77 VanDerWaalsContact CE1-CD1 3.48Å; L73-L77 HydrophobicContact CG-CD1 4.43Å; L73-L77 WeakPolarHBondContact O-CG 3.29Å; L73-L77 PolarHBondContact O-N 3.34Å; C74-L77 PolarHBondContact O-N 2.96Å; R75-L77 VanDerWaalsContact C-N 3.25Å; R75-L77 PolarHBondContact O-N 3.14Å; L77-R80 PolarHBondContact O-N 3.1Å; L77-L81 WeakPolarHBondContact O-CB 3.41Å; L77-L81 PolarHBondContact O-N 2.86Å
78	D	89.2	Confident	84.1	Confident	41 Å²	41	74 Å²	74	22%	0.219	39%	0.386	C	S	.	.	H	α-helix	trans	-63.4	-44.7	174.8	-78.5	-38.8	0	0	0	111.8	S59 G60 K61 C74 R75 R80 L81 Q82	S59-D78 WeakPolarHBondContact CB-OD1 3.44Å; G60-D78 WeakPolarHBondContact CA-OD1 3.43Å; G60-D78 PolarHBondContact N-OD1 3.35Å; K61-D78 PolarHBondContact N-OD2 3.38Å; C74-D78 PolarHBondContact O-N 3.33Å; R75-D78 PolarHBondContact O-N 2.7Å; D78-R80 PolarHBondContact O-N 3.46Å; D78-L81 PolarHBondContact O-N 2.93Å; D78-Q82 WeakPolarHBondContact O-CB 3.35Å; D78-Q82 PolarHBondContact O-N 2.64Å
79	E	87.6	Confident	82.4	Confident	97 Å²	97	71.2 Å²	71.2	45%	0.453	38%	0.384	S	S	.	.	H	α-helix	trans	-61.3	-44.4	176.2	-74.5	173.1	-158.1	0	0	111.7	R75 Q82 R83	R75-E79 WeakPolarHBondContact O-CG 3.48Å; R75-E79 PolarHBondContact O-N 3.06Å; E79-Q82 PolarHBondContact O-N 3.12Å; E79-R83 WeakPolarHBondContact O-CG 3.28Å; E79-R83 PolarHBondContact O-N 3.18Å
80	R	89.4	Confident	80.5	Confident	81 Å²	81	76.5 Å²	76.5	31%	0.306	41%	0.412	S	S	.	.	H	α-helix	trans	-70.2	-34.1	179.1	-164.3	154.4	-178.1	120.5	-10.2	112.2	W24 E27 W28 M76 L77 D78 R83 H84	W24-R80 HydrophobicContact CD2-CB 4.45Å; W24-R80 HydrophobicContact CD2-CG 3.84Å; W24-R80 HydrophobicContact CE3-CB 4.19Å; W24-R80 HydrophobicContact CE3-CG 4.09Å; W24-R80 HydrophobicContact CG-CG 4.13Å; W24-R80 HydrophobicContact CZ3-CB 4.41Å; W24-R80 HydrophobicContact CZ3-CG 4.5Å; E27-R80 IonicContact OE2-CZ 2.66Å; E27-R80 IonicContact OE2-NE 3.59Å; E27-R80 IonicContact OE2-NH2 3.29Å; E27-R80 PolarHBondContact OE2-NH2 3.33Å; W28-R80 HydrophobicContact CH2-CB 4.43Å; W28-R80 HydrophobicContact CZ2-CB 4.11Å; W28-R80 HydrophobicContact CZ2-CG 4.35Å; M76-R80 WeakPolarHBondContact O-CB 3.33Å; M76-R80 PolarHBondContact O-N 3.21Å; L77-R80 PolarHBondContact O-N 3.1Å; D78-R80 PolarHBondContact O-N 3.46Å; R80-R83 PolarHBondContact O-N 2.75Å; R80-H84 WeakPolarHBondContact O-CB 3.45Å; R80-H84 PolarHBondContact O-N 2.87Å
81	L	89.6	Confident	78.4	Confident	14 Å²	14	83.5 Å²	83.5	7%	0.073	43%	0.434	C	S	.	.	H	α-helix	trans	-67.2	-38.8	173.3	-174.7	62.6	0	0	0	111.7	F21 W24 R58 L77 D78 H84 R85	F21-L81 HydrophobicContact CE1-CD1 4.3Å; F21-L81 HydrophobicContact CE1-CD2 4.19Å; F21-L81 HydrophobicContact CZ-CD2 4.18Å; W24-L81 HydrophobicContact CH2-CB 4.07Å; W24-L81 HydrophobicContact CH2-CD1 3.74Å; W24-L81 HydrophobicContact CZ3-CB 4Å; W24-L81 HydrophobicContact CZ3-CD1 4.21Å; R58-L81 VanDerWaalsContact O-CD2 3.27Å; R58-L81 WeakPolarHBondContact O-CD2 3.37Å; L77-L81 WeakPolarHBondContact O-CB 3.41Å; L77-L81 PolarHBondContact O-N 2.86Å; D78-L81 PolarHBondContact O-N 2.93Å; L81-H84 PolarHBondContact O-N 2.83Å; L81-R85 VanDerWaalsContact O-CG 3.29Å; L81-R85 WeakPolarHBondContact O-CG 3.31Å; L81-R85 PolarHBondContact O-N 2.85Å
82	Q	85.9	Confident	76	Confident	132 Å²	132	83.7 Å²	83.7	62%	0.617	45%	0.447	S	S	*	.	H	α-helix	trans	-65.3	-45.2	175.1	-169.7	168.7	8.4	0	0	111.2	D78 E79 H84 R85 T86	D78-Q82 WeakPolarHBondContact O-CB 3.35Å; D78-Q82 PolarHBondContact O-N 2.64Å; E79-Q82 PolarHBondContact O-N 3.12Å; Q82-H84 VanDerWaalsContact C-N 3.34Å; Q82-H84 PolarHBondContact O-N 2.76Å; Q82-R85 WeakPolarHBondContact O-CB 2.86Å; Q82-R85 PolarHBondContact O-N 3.12Å; Q82-R85 VanDerWaalsContact O-N 3.12Å; Q82-T86 PolarHBondContact O-N 3Å; Q82-T86 PolarHBondContact O-OG1 3.37Å
83	R	85.8	Confident	74.1	Confident	158 Å²	158	87.8 Å²	87.8	60%	0.596	47%	0.465	S	S	*	.	H	α-helix	trans	-58.9	-44.1	173.8	-70	178	-163.4	170.2	9	112.1	E79 R80 R85 T86 S87	E79-R83 WeakPolarHBondContact O-CG 3.28Å; E79-R83 PolarHBondContact O-N 3.18Å; R80-R83 PolarHBondContact O-N 2.75Å; R83-R85 VanDerWaalsContact C-N 3.27Å; R83-R85 PolarHBondContact O-N 3.36Å; R83-T86 WeakPolarHBondContact CA-OG1 3.46Å; R83-T86 PolarHBondContact O-N 3.4Å; R83-T86 PolarHBondContact O-OG1 3.08Å; R83-S87 WeakPolarHBondContact O-CB 3.37Å; R83-S87 PolarHBondContact O-N 2.98Å; R83-S87 PolarHBondContact O-OG 2.83Å
84	H	85.1	Confident	71.2	Confident	44 Å²	44	90.8 Å²	90.8	20%	0.204	50%	0.499	C	S	.	.	H	α-helix	trans	-64.7	-30.6	176.9	-173.1	-75.1	0	0	0	112.9	W24 R80 L81 Q82	W24-H84 HydrophobicContact CH2-CB 4.23Å; W24-H84 HydrophobicContact CZ2-CB 3.91Å; W24-H84 AromaticContact CZ2-CD2 3.8Å; W24-H84 AromaticContact CZ2-CG 3.93Å; R80-H84 WeakPolarHBondContact O-CB 3.45Å; R80-H84 PolarHBondContact O-N 2.87Å; L81-H84 PolarHBondContact O-N 2.83Å; Q82-H84 VanDerWaalsContact C-N 3.34Å; Q82-H84 PolarHBondContact O-N 2.76Å
85	R	83.8	Confident	68.2	Low	166 Å²	166	96.1 Å²	96.1	63%	0.626	54%	0.536	S	S	*	.	H	α-helix	trans	-73.6	-38.9	174.8	-74.2	171.1	179.3	164.8	3.6	112	R58 L81 Q82 R83 S87	R58-R85 PolarHBondContact O-NH2 3.33Å; L81-R85 VanDerWaalsContact O-CG 3.29Å; L81-R85 WeakPolarHBondContact O-CG 3.31Å; L81-R85 PolarHBondContact O-N 2.85Å; Q82-R85 WeakPolarHBondContact O-CB 2.86Å; Q82-R85 PolarHBondContact O-N 3.12Å; Q82-R85 VanDerWaalsContact O-N 3.12Å; R83-R85 VanDerWaalsContact C-N 3.27Å; R83-R85 PolarHBondContact O-N 3.36Å; R85-S87 VanDerWaalsContact C-N 3.35Å
86	T	78.3	Confident	66	Low	111 Å²	111	93.4 Å²	93.4	68%	0.681	54%	0.541	S	S	*	.	H	α-helix	trans	-73.9	-24.7	178.4	50.4	0	0	0	0	113.3	Q82 R83	Q82-T86 PolarHBondContact O-N 3Å; Q82-T86 PolarHBondContact O-OG1 3.37Å; R83-T86 WeakPolarHBondContact CA-OG1 3.46Å; R83-T86 PolarHBondContact O-N 3.4Å; R83-T86 PolarHBondContact O-OG1 3.08Å
87	S	74.7	Confident	62.9	Low	99 Å²	99	96.2 Å²	96.2	69%	0.692	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.7	4	-179.4	-61.5	0	0	0	0	114.9	R83 R85	R83-S87 WeakPolarHBondContact O-CB 3.37Å; R83-S87 PolarHBondContact O-N 2.98Å; R83-S87 PolarHBondContact O-OG 2.83Å; R85-S87 VanDerWaalsContact C-N 3.35Å
88	G	56.8	Low	59.8	Low	59 Å²	59	99.4 Å²	99.4	61%	0.608	60%	0.601	S	S	*	*			trans	69.4	96.5	-176.9	0	0	0	0	0	111.8
89	G	51.1	Low	56.9	Low	39 Å²	39	105.9 Å²	105.9	40%	0.402	63%	0.63	S	S	.	*	P	Polyproline II helix	trans	-57	146.9	-171.1	0	0	0	0	0	115.1	H91	G89-H91 PolarHBondContact O-N 3.08Å
90	D	46.4	Very low	54	Low	123 Å²	123	108.1 Å²	108.1	66%	0.658	65%	0.645	S	S	*	*	P	Polyproline II helix	trans	-50.8	117.7	178.1	-74.1	-29.7	0	0	0	112.3	R23	R23-D90 IonicContact NH1-OD2 2.72Å; R23-D90 PolarHBondContact NH1-OD2 3.41Å
91	H	36.7	Very low	51	Low	189 Å²	189	109.6 Å²	109.6	88%	0.875	67%	0.668	S	S	*	*	P	Polyproline II helix	trans	-69.3	140.6	160.3	-83.3	-82.1	0	0	0	110.1	G89	G89-H91 PolarHBondContact O-N 3.08Å
92	A	29.9	Very low	48.1	Very low	93 Å²	93	115 Å²	115	77%	0.769	70%	0.704	S	S	*	*	P	Polyproline II helix	trans	-62	155.7	178.2	0	0	0	0	0	112.9
93	P	40.7	Very low	45.2	Very low	135 Å²	135	112.8 Å²	112.8	88%	0.877	71%	0.708	S	S	*	*	P	Polyproline II helix	trans	-82.2	132.5	-161.3	32.3	-32.8	0	0	0	113.4
94	G	26.3	Very low	43.1	Very low	76 Å²	76	110.2 Å²	110.2	78%	0.784	71%	0.712	S	S	*	*			trans	-134.6	120.8	156.4	0	0	0	0	0	108.3
95	S	25.4	Very low	40.2	Very low	117 Å²	117	117.3 Å²	117.3	82%	0.818	75%	0.745	S	S	*	*			trans	-71.8	178.3	176.2	-55.9	0	0	0	0	112.3
96	P	43.1	Very low	37.4	Very low	115 Å²	115	112.8 Å²	112.8	75%	0.747	75%	0.75	S	S	*	*			cis	-133	155.2	-39.3	31.5	-14.5	0	0	0	112.9
97	S	25.4	Very low	34.7	Very low	132 Å²	132	119.2 Å²	119.2	92%	0.923	76%	0.762	S	S	*	*			trans	156.7	145.8	154.1	34	0	0	0	0	107.2
98	G	25.1	Very low	32.8	Very low	67 Å²	67	119.8 Å²	119.8	69%	0.691	76%	0.763	S	S	*	*			cis	-173	139.9	-0.8	0	0	0	0	0	105.5
99	E	27.3	Very low	31.3	Very low	177 Å²	177	121.3 Å²	121.3	83%	0.827	77%	0.77	S	S	*	*			trans	51.9	138.7	148.7	-70.3	-176.8	158.2	0	0	124.3
100	N	27.2	Very low	30	Very low	143 Å²	143	128.7 Å²	128.7	77%	0.765	79%	0.794	S	S	*	*			trans	92.1	103.1	148	-58.3	-23.6	0	0	0	120
101	S	27.2	Very low	28.9	Very low	113 Å²	113	129.3 Å²	129.3	79%	0.79	80%	0.802	S	S	*	*			trans	-68.7	159.9	145.8	-52	0	0	0	0	109.4
102	P	28.8	Very low	28.4	Very low	127 Å²	127	129.7 Å²	129.7	83%	0.825	80%	0.804	S	S	*	*				-148.1	159.3	82.1	37.6	-18.2	0	0	0	115.8
103	A	24.3	Very low	28	Very low	86 Å²	86	132.1 Å²	132.1	71%	0.711	80%	0.804	S	S	*	*			trans	-76.1	179.6	155.3	0	0	0	0	0	109
104	P	40.6	Very low	27.2	Very low	104 Å²	104	131.4 Å²	131.4	68%	0.675	80%	0.802	S	S	*	*			cis	-154.1	-166	28.5	32.4	-3.7	0	0	0	117.1
105	Q	25.9	Very low	27.1	Very low	192 Å²	192	132.5 Å²	132.5	90%	0.897	80%	0.798	S	S	*	*			trans	88.3	138.3	159	-52.4	176.4	10	0	0	116.8
106	G	23.4	Very low	27	Very low	71 Å²	71	135.6 Å²	135.6	73%	0.732	80%	0.802	S	S	*	*			cis	159.7	117.7	-3.5	0	0	0	0	0	111.1
107	R	22.2	Very low	26.1	Very low	246 Å²	246	135.4 Å²	135.4	93%	0.928	80%	0.801	S	S	*	*			trans	53.5	170.8	152.6	-69.8	-171.4	178.1	179.3	0.6	120.9
108	P	35.8	Very low	26	Very low	112 Å²	112	135.1 Å²	135.1	73%	0.727	79%	0.793	S	S	*	*				-137.6	-179.4	-58.2	41.2	-23.7	0	0	0	114.2
109	A	23.8	Very low	25.9	Very low	91 Å²	91	137.5 Å²	137.5	75%	0.752	80%	0.796	S	S	*	*			trans	80.1	120.5	157.1	0	0	0	0	0	119.6
110	E	24.5	Very low	25.8	Very low	194 Å²	194	133.8 Å²	133.8	91%	0.907	80%	0.796	S	S	*	*				-171.4	145.7	101	-99.7	178.4	178.6	0	0	111.6
111	V	24.3	Very low	25.8	Very low	136 Å²	136	135.3 Å²	135.3	82%	0.824	80%	0.798	S	S	*	*			trans	-98.3	132.1	-176.9	174.3	0	0	0	0	107.8
112	Q	24.5	Very low	25.7	Very low	196 Å²	196	135.5 Å²	135.5	92%	0.916	80%	0.8	S	S	*	*			trans	-151.3	143	148.5	-113.9	171.9	45.4	0	0	112.6
113	D	21.6	Very low	25.6	Very low	144 Å²	144	139.1 Å²	139.1	77%	0.77	80%	0.803	S	S	*	*			trans	-86.8	140.4	-158.4	-160.9	2.1	0	0	0	111
114	S	25.6	Very low	25.8	Very low	120 Å²	120	140.1 Å²	140.1	84%	0.839	81%	0.811	S	S	*	*			trans	-154.2	107.2	157.6	38.8	0	0	0	0	109.6
115	S	23	Very low	25.2	Very low	100 Å²	100	139.2 Å²	139.2	70%	0.699	82%	0.821	S	S	*	*			trans	-77.6	144	-176.7	42.6	0	0	0	0	112.3
116	M	22.9	Very low	25.2	Very low	182 Å²	182	133.6 Å²	133.6	90%	0.897	81%	0.814	S	S	*	*			trans	-174.5	160.7	154.9	-100.8	-39.3	172.3	0	0	109.5
117	P	23.9	Very low	25.7	Very low	111 Å²	111	136.7 Å²	136.7	72%	0.721	82%	0.824	S	S	*	*	P	Polyproline II helix		-95	153.3	-112.6	16.7	1.4	0	0	0	115.6
118	V	24.6	Very low	26.2	Very low	125 Å²	125	127.8 Å²	127.8	76%	0.758	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-74.7	125.7	178.5	-179.9	0	0	0	0	111.5
119	P	23.5	Very low	26.9	Very low	117 Å²	117	129.6 Å²	129.6	76%	0.76	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-77.7	120.4	153.1	-4.2	22.3	0	0	0	108.2	Q121	P119-Q121 PolarHBondContact O-N 2.83Å; P119-Q121 VanDerWaalsContact O-N 3.13Å
120	A	23.9	Very low	29	Very low	99 Å²	99	128 Å²	128	82%	0.818	79%	0.788	S	S	*	*			trans	-42	113.1	-175.5	0	0	0	0	0	113.6	S122	A120-S122 PolarHBondContact O-N 3.06Å
121	Q	27.7	Very low	31.2	Very low	175 Å²	175	124.8 Å²	124.8	82%	0.818	77%	0.767	S	S	*	*			trans	-67.4	121.9	161.8	-69.5	178.8	-8	0	0	108.5	P119 K123	P119-Q121 PolarHBondContact O-N 2.83Å; P119-Q121 VanDerWaalsContact O-N 3.13Å; Q121-K123 PolarHBondContact O-N 2.93Å; Q121-K123 VanDerWaalsContact O-N 3.12Å
122	S	24.8	Very low	33.6	Very low	118 Å²	118	118.5 Å²	118.5	83%	0.825	73%	0.729	S	S	*	*			trans	-63	109.9	169.5	54.1	0	0	0	0	109.5	A120 A124	A120-S122 PolarHBondContact O-N 3.06Å; S122-A124 PolarHBondContact O-N 3.26Å
123	K	27.1	Very low	35.8	Very low	203 Å²	203	112.4 Å²	112.4	88%	0.883	71%	0.713	S	S	*	*			trans	-62.2	129.6	172.2	-72.8	-177.6	175.7	-179.8	0	110.4	Q121	Q121-K123 PolarHBondContact O-N 2.93Å; Q121-K123 VanDerWaalsContact O-N 3.12Å
124	A	28.6	Very low	37.4	Very low	106 Å²	106	114.8 Å²	114.8	88%	0.876	71%	0.711	S	S	*	*			trans	-77.3	142	154.8	0	0	0	0	0	108.9	S122	S122-A124 PolarHBondContact O-N 3.26Å
125	G	27.1	Very low	39	Very low	86 Å²	86	117 Å²	117	89%	0.887	71%	0.708	S	S	*	*			trans	121.4	106.6	166.5	0	0	0	0	0	114
126	G	26	Very low	41.4	Very low	74 Å²	74	113.8 Å²	113.8	76%	0.763	69%	0.685	S	S	*	*			trans	169.1	87.1	169.7	0	0	0	0	0	110.6	G128	G126-G128 PolarHBondContact O-N 3.43Å
127	S	33.4	Very low	43.6	Very low	135 Å²	135	106 Å²	106	94%	0.944	65%	0.651	S	S	*	*			trans	-62.8	69.7	158.4	52.2	0	0	0	0	108.9
128	G	34.4	Very low	45.8	Very low	59 Å²	59	101 Å²	101	61%	0.608	62%	0.619	S	S	*	*			trans	-97.3	120.4	173.3	0	0	0	0	0	108.2	G126 Y130	G126-G128 PolarHBondContact O-N 3.43Å; G128-Y130 PolarHBondContact O-N 3.27Å
129	N	49.5	Very low	48.2	Very low	150 Å²	150	95.2 Å²	95.2	80%	0.802	58%	0.583	S	S	*	*			trans	-43.3	100.6	177	-149.5	12.6	0	0	0	110.2	W131	N129-W131 PolarHBondContact O-N 2.89Å
130	Y	68.3	Low	50.6	Low	59 Å²	59	92.5 Å²	92.5	23%	0.231	57%	0.565	C	S	.	*			trans	-71.2	107.7	-173.5	171.5	-110.9	0	0	0	109.3	G128 P132 A138 L188 L193 L212	G128-Y130 PolarHBondContact O-N 3.27Å; Y130-P132 HydrophobicContact CD1-CG 4.29Å; Y130-P132 HydrophobicContact CE1-CG 3.71Å; Y130-A138 WeakPolarHBondContact OH-CB 3.42Å; Y130-L188 HydrophobicContact CE1-CD2 4.06Å; Y130-L193 HydrophobicContact CD1-CD1 3.47Å; Y130-L193 VanDerWaalsContact CD1-CD1 3.47Å; Y130-L193 HydrophobicContact CE1-CD1 3.62Å; Y130-L212 HydrophobicContact CD1-CD2 3.8Å; Y130-L212 HydrophobicContact CE1-CD2 4.36Å; Y130-L212 VanDerWaalsContact O-CD1 3.26Å; Y130-L212 WeakPolarHBondContact O-CD1 3.37Å; Y130-L212 WeakPolarHBondContact O-CD2 3.35Å
131	W	70.3	Confident	53.2	Low	126 Å²	126	88 Å²	88	48%	0.477	53%	0.527	S	S	.	.			trans	-112.3	109.1	176.7	-170.3	-97.4	0	0	0	110.9	N129 L212 K215 L216 S219	N129-W131 PolarHBondContact O-N 2.89Å; W131-L212 HydrophobicContact CE3-CD1 4.26Å; W131-K215 HydrophobicContact CZ3-CB 4.13Å; W131-L216 HydrophobicContact CD2-CD2 3.83Å; W131-L216 HydrophobicContact CE3-CD2 3.87Å; W131-L216 HydrophobicContact CH2-CD2 3.63Å; W131-L216 HydrophobicContact CH2-CG 4.24Å; W131-L216 HydrophobicContact CZ2-CD2 3.57Å; W131-L216 HydrophobicContact CZ3-CD2 3.77Å; W131-L216 HydrophobicContact CZ3-CG 4.18Å; W131-S219 WeakPolarHBondContact CZ2-OG 3.43Å
132	P	75.6	Confident	55.6	Low	3 Å²	3	79.6 Å²	79.6	2%	0.019	49%	0.488	C	S	.	.			trans	-62.7	134.3	176.7	-23	32.7	0	0	0	112.9	Y130 R139 L142 L216	Y130-P132 HydrophobicContact CD1-CG 4.29Å; Y130-P132 HydrophobicContact CE1-CG 3.71Å; P132-R139 HydrophobicContact CB-CB 3.69Å; P132-R139 HydrophobicContact CB-CG 4.15Å; P132-R139 PolarHBondContact O-NH1 2.78Å; P132-L142 HydrophobicContact CG-CD1 3.89Å; P132-L216 HydrophobicContact CG-CD1 4.06Å
133	A	71.1	Confident	58.1	Low	69 Å²	69	75 Å²	75	57%	0.57	45%	0.454	S	S	*	.			trans	-60.5	148.2	175.3	0	0	0	0	0	112	H135 S136 R139	A133-H135 PolarHBondContact O-N 3.28Å; A133-S136 WeakPolarHBondContact O-CB 3.32Å; A133-S136 PolarHBondContact O-N 3.38Å; A133-S136 PolarHBondContact O-OG 2.9Å; A133-R139 VanDerWaalsContact O-CD 3.27Å; A133-R139 WeakPolarHBondContact O-CD 3.06Å
134	R	53.8	Low	60.5	Low	194 Å²	194	66 Å²	66	73%	0.732	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.9	-25.8	-171.3	-73.5	-173.4	178.9	-159.6	-1.4	115.2
135	H	60	Low	62.8	Low	167 Å²	167	61.3 Å²	61.3	77%	0.773	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.5	16.2	179.4	-53.8	-60.6	0	0	0	113.7	A133	A133-H135 PolarHBondContact O-N 3.28Å
136	S	73.8	Confident	65.2	Low	32 Å²	32	58.9 Å²	58.9	22%	0.224	34%	0.339	C	S	.	.			trans	-79.8	141.1	179.5	68.4	0	0	0	0	111.8	A133 A138 R139 V140	A133-S136 WeakPolarHBondContact O-CB 3.32Å; A133-S136 PolarHBondContact O-N 3.38Å; A133-S136 PolarHBondContact O-OG 2.9Å; S136-A138 PolarHBondContact O-N 3.44Å; S136-A138 VanDerWaalsContact O-N 3.1Å; S136-R139 WeakPolarHBondContact O-CB 3.34Å; S136-R139 PolarHBondContact O-N 3.37Å; S136-R139 PolarHBondContact OG-N 2.86Å; S136-V140 PolarHBondContact O-N 3.06Å
137	G	67.9	Low	67.7	Low	17 Å²	17	60.5 Å²	60.5	18%	0.175	32%	0.322	C	S	.	.	H	α-helix	trans	-57.6	-25.2	174.5	0	0	0	0	0	113.6	I141	G137-I141 WeakPolarHBondContact O-CD1 3.49Å; G137-I141 VanDerWaalsContact O-CG1 3.23Å; G137-I141 WeakPolarHBondContact O-CG1 3.25Å; G137-I141 PolarHBondContact O-N 3.3Å; G137-I141 VanDerWaalsContact O-N 3.16Å
138	A	70.9	Confident	69.7	Low	6 Å²	6	55 Å²	55	5%	0.05	28%	0.282	C	S	.	.	H	α-helix	trans	-68.4	-40.5	175.5	0	0	0	0	0	112.2	Y130 S136 I141 L142 A184 L188	Y130-A138 WeakPolarHBondContact OH-CB 3.42Å; S136-A138 PolarHBondContact O-N 3.44Å; S136-A138 VanDerWaalsContact O-N 3.1Å; A138-I141 PolarHBondContact O-N 2.89Å; A138-L142 WeakPolarHBondContact O-CG 3.31Å; A138-L142 PolarHBondContact O-N 3.4Å; A138-L142 VanDerWaalsContact O-N 3.15Å; A138-A184 HydrophobicContact CB-CB 4.09Å; A138-L188 HydrophobicContact CB-CD1 4.26Å; A138-L188 HydrophobicContact CB-CD2 4.19Å; A138-L188 HydrophobicContact CB-CG 4.24Å
139	R	74.6	Confident	71.6	Confident	4 Å²	4	56 Å²	56	2%	0.015	27%	0.27	C	S	.	.	H	α-helix	trans	-64.6	-42.8	176.5	-163.8	173.9	175.7	105.8	7.7	111.7	P132 A133 S136 I141 L142 L143 L216 S219 E220	P132-R139 HydrophobicContact CB-CB 3.69Å; P132-R139 HydrophobicContact CB-CG 4.15Å; P132-R139 PolarHBondContact O-NH1 2.78Å; A133-R139 VanDerWaalsContact O-CD 3.27Å; A133-R139 WeakPolarHBondContact O-CD 3.06Å; S136-R139 WeakPolarHBondContact O-CB 3.34Å; S136-R139 PolarHBondContact O-N 3.37Å; S136-R139 PolarHBondContact OG-N 2.86Å; R139-I141 PolarHBondContact O-N 3.35Å; R139-L142 PolarHBondContact O-N 3.46Å; R139-L143 HydrophobicContact CG-CD1 4.3Å; R139-L143 WeakPolarHBondContact O-CG 3.27Å; R139-L143 PolarHBondContact O-N 2.92Å; R139-L143 VanDerWaalsContact O-N 3.1Å; R139-L216 HydrophobicContact CG-CD2 4.45Å; R139-L216 VanDerWaalsContact CZ-CD2 3.42Å; R139-S219 PolarHBondContact NH2-OG 3.26Å; R139-S219 VanDerWaalsContact NH2-OG 3.1Å; R139-E220 IonicContact CZ-OE1 2.66Å; R139-E220 VanDerWaalsContact CZ-OE1 3.26Å; R139-E220 IonicContact NE-OE1 3.62Å; R139-E220 PolarHBondContact NE-OE1 3.28Å; R139-E220 IonicContact NH2-OE1 3.88Å; R139-E220 PolarHBondContact NH2-OE1 3.15Å
140	V	74.8	Confident	72.6	Confident	60 Å²	60	53.8 Å²	53.8	36%	0.364	26%	0.258	S	S	.	.	H	α-helix	trans	-60.8	-45.5	177.8	176.2	0	0	0	0	111.1	S136 M144	S136-V140 PolarHBondContact O-N 3.06Å; V140-M144 HydrophobicContact CG1-CG 4.47Å; V140-M144 HydrophobicContact CG1-SD 3.73Å; V140-M144 WeakPolarHBondContact O-CB 3.33Å; V140-M144 WeakPolarHBondContact O-CG 3.37Å; V140-M144 PolarHBondContact O-N 3.41Å
141	I	76.6	Confident	72.7	Confident	4 Å²	4	54.6 Å²	54.6	2%	0.021	27%	0.266	C	S	.	.	H	α-helix	trans	-63.8	-43.7	179.6	-69.8	165.7	0	0	0	111.5	G137 A138 R139 M144 L145 P181 A184 L185 L188	G137-I141 WeakPolarHBondContact O-CD1 3.49Å; G137-I141 VanDerWaalsContact O-CG1 3.23Å; G137-I141 WeakPolarHBondContact O-CG1 3.25Å; G137-I141 PolarHBondContact O-N 3.3Å; G137-I141 VanDerWaalsContact O-N 3.16Å; A138-I141 PolarHBondContact O-N 2.89Å; R139-I141 PolarHBondContact O-N 3.35Å; I141-M144 PolarHBondContact O-N 3.36Å; I141-L145 HydrophobicContact CG2-CD1 3.96Å; I141-L145 WeakPolarHBondContact O-CG 3.4Å; I141-L145 PolarHBondContact O-N 3.11Å; I141-P181 HydrophobicContact CD1-CB 4.32Å; I141-P181 WeakPolarHBondContact CD1-O 3.45Å; I141-A184 HydrophobicContact CD1-CB 4.22Å; I141-L185 HydrophobicContact CD1-CB 4.02Å; I141-L185 HydrophobicContact CD1-CD1 4.34Å; I141-L185 HydrophobicContact CG2-CD1 3.81Å; I141-L188 HydrophobicContact CB-CD1 4.03Å; I141-L188 HydrophobicContact CG2-CD1 3.79Å
142	L	78	Confident	71.9	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-62.7	-46.4	179.2	-72.4	170.5	0	0	0	112	P132 A138 R139 M144 L145 Y146 L188 L193 V194 L205 L212 A213 L216	P132-L142 HydrophobicContact CG-CD1 3.89Å; A138-L142 WeakPolarHBondContact O-CG 3.31Å; A138-L142 PolarHBondContact O-N 3.4Å; A138-L142 VanDerWaalsContact O-N 3.15Å; R139-L142 PolarHBondContact O-N 3.46Å; L142-M144 VanDerWaalsContact C-N 3.3Å; L142-M144 PolarHBondContact O-N 3.31Å; L142-L145 PolarHBondContact O-N 2.87Å; L142-Y146 VanDerWaalsContact O-CB 3.32Å; L142-Y146 WeakPolarHBondContact O-CB 3.25Å; L142-Y146 PolarHBondContact O-N 3.15Å; L142-L188 HydrophobicContact CD1-CD2 4.07Å; L142-L188 HydrophobicContact CD2-CD1 4.41Å; L142-L188 HydrophobicContact CD2-CD2 4.3Å; L142-L188 HydrophobicContact CG-CD1 4.18Å; L142-L188 HydrophobicContact CG-CD2 4.21Å; L142-L193 HydrophobicContact CD2-CB 4.41Å; L142-V194 HydrophobicContact CD2-CG2 4.46Å; L142-L205 HydrophobicContact CD2-CD2 3.6Å; L142-L212 HydrophobicContact CD1-CD2 3.95Å; L142-L212 HydrophobicContact CD1-CG 4.42Å; L142-A213 HydrophobicContact CB-CB 4.18Å; L142-L216 HydrophobicContact CB-CD1 4.46Å; L142-L216 HydrophobicContact CD1-CD1 3.93Å
143	L	78.5	Confident	71	Confident	21 Å²	21	62.1 Å²	62.1	11%	0.11	32%	0.322	C	S	.	.	H	α-helix	trans	-65.9	-31.9	178.1	-69.6	170.8	0	0	0	112.8	R139 R147 L216 A217 E220	R139-L143 HydrophobicContact CG-CD1 4.3Å; R139-L143 WeakPolarHBondContact O-CG 3.27Å; R139-L143 PolarHBondContact O-N 2.92Å; R139-L143 VanDerWaalsContact O-N 3.1Å; L143-R147 WeakPolarHBondContact O-CG 3.38Å; L143-R147 PolarHBondContact O-N 3.49Å; L143-R147 VanDerWaalsContact O-N 3.09Å; L143-L216 HydrophobicContact CD2-CB 4.18Å; L143-A217 HydrophobicContact CD2-CB 3.96Å; L143-E220 VanDerWaalsContact CD1-OE2 3.3Å; L143-E220 WeakPolarHBondContact CD1-OE2 3.44Å
144	M	76.3	Confident	70.4	Confident	15 Å²	15	59.6 Å²	59.6	7%	0.074	30%	0.303	C	S	.	.	H	α-helix	trans	-72.1	-44.5	177.4	-75.4	175.9	62.5	0	0	112.5	V140 I141 L142 Y146 R147 E148 L163 R166	V140-M144 HydrophobicContact CG1-CG 4.47Å; V140-M144 HydrophobicContact CG1-SD 3.73Å; V140-M144 WeakPolarHBondContact O-CB 3.33Å; V140-M144 WeakPolarHBondContact O-CG 3.37Å; V140-M144 PolarHBondContact O-N 3.41Å; I141-M144 PolarHBondContact O-N 3.36Å; L142-M144 VanDerWaalsContact C-N 3.3Å; L142-M144 PolarHBondContact O-N 3.31Å; M144-Y146 VanDerWaalsContact C-N 3.27Å; M144-Y146 PolarHBondContact O-N 2.98Å; M144-R147 PolarHBondContact O-N 3.25Å; M144-E148 PolarHBondContact O-N 3.33Å; M144-E148 VanDerWaalsContact O-N 3.14Å; M144-L163 HydrophobicContact CE-CD2 4.49Å; M144-R166 HydrophobicContact CE-CB 3.22Å; M144-R166 HydrophobicContact CE-CG 4.39Å
145	L	77.9	Confident	70.7	Confident	6 Å²	6	59.2 Å²	59.2	3%	0.031	30%	0.303	C	S	.	.	H	α-helix	trans	-66.7	-32.7	175.1	-68.5	168.7	0	0	0	111.3	I141 L142 E148 H149 L158 L163 V194 Y203 L205	I141-L145 HydrophobicContact CG2-CD1 3.96Å; I141-L145 WeakPolarHBondContact O-CG 3.4Å; I141-L145 PolarHBondContact O-N 3.11Å; L142-L145 PolarHBondContact O-N 2.87Å; L145-E148 PolarHBondContact O-N 3.24Å; L145-H149 WeakPolarHBondContact O-CB 3.45Å; L145-H149 PolarHBondContact O-N 3.48Å; L145-L158 HydrophobicContact CD2-CB 4.07Å; L145-L158 HydrophobicContact CD2-CD1 3.92Å; L145-L158 HydrophobicContact CD2-CG 4.06Å; L145-L163 HydrophobicContact CD2-CD2 4.41Å; L145-V194 HydrophobicContact CD1-CG1 4.11Å; L145-V194 HydrophobicContact CD1-CG2 3.84Å; L145-Y203 WeakPolarHBondContact CD2-O 3.41Å; L145-L205 HydrophobicContact CB-CD1 3.9Å; L145-L205 HydrophobicContact CB-CD2 3.94Å; L145-L205 HydrophobicContact CB-CG 3.64Å; L145-L205 HydrophobicContact CD1-CD2 4Å; L145-L205 HydrophobicContact CD1-CG 4.31Å
146	Y	77.9	Confident	71.1	Confident	35 Å²	35	55.7 Å²	55.7	14%	0.137	29%	0.287	C	S	.	.	H	α-helix	trans	-65	-44	174.4	-175.3	-110.7	0	0	0	112.3	L142 M144 E148 H149 L150 L210 A213 Q214 A217	L142-Y146 VanDerWaalsContact O-CB 3.32Å; L142-Y146 WeakPolarHBondContact O-CB 3.25Å; L142-Y146 PolarHBondContact O-N 3.15Å; M144-Y146 VanDerWaalsContact C-N 3.27Å; M144-Y146 PolarHBondContact O-N 2.98Å; Y146-E148 VanDerWaalsContact C-N 3.33Å; Y146-E148 PolarHBondContact O-N 3.02Å; Y146-H149 WeakPolarHBondContact O-CB 3.4Å; Y146-H149 PolarHBondContact O-N 3.19Å; Y146-H149 VanDerWaalsContact O-N 3.17Å; Y146-L150 HydrophobicContact CD1-CD1 3.97Å; Y146-L150 HydrophobicContact CE1-CD1 3.57Å; Y146-L150 HydrophobicContact CE1-CG 4.37Å; Y146-L150 WeakPolarHBondContact O-CG 3.38Å; Y146-L150 PolarHBondContact O-N 3.12Å; Y146-L150 VanDerWaalsContact O-N 3.08Å; Y146-L210 HydrophobicContact CD2-CD1 3.72Å; Y146-L210 HydrophobicContact CE2-CD1 3.99Å; Y146-A213 HydrophobicContact CD2-CB 4.06Å; Y146-A213 HydrophobicContact CG-CB 4.08Å; Y146-Q214 HydrophobicContact CE2-CB 3.88Å; Y146-A217 HydrophobicContact CD1-CB 4Å; Y146-A217 HydrophobicContact CE1-CB 3.76Å
147	R	77.1	Confident	71.1	Confident	108 Å²	108	56.1 Å²	56.1	41%	0.408	29%	0.285	S	S	.	.	H	α-helix	trans	-63.2	-37.4	174.5	-73.2	179.5	-170.7	-150.7	2.8	113	L143 M144 H149 L150	L143-R147 WeakPolarHBondContact O-CG 3.38Å; L143-R147 PolarHBondContact O-N 3.49Å; L143-R147 VanDerWaalsContact O-N 3.09Å; M144-R147 PolarHBondContact O-N 3.25Å; R147-H149 VanDerWaalsContact C-N 3.33Å; R147-L150 PolarHBondContact O-N 3.03Å
148	E	76.5	Confident	71.5	Confident	20 Å²	20	55.4 Å²	55.4	9%	0.093	28%	0.277	C	S	.	.	H	α-helix	trans	-69.5	-33.9	174.8	-166.1	65.4	-144.2	0	0	111.7	M144 L145 Y146 L150 N151 L158 R166	M144-E148 PolarHBondContact O-N 3.33Å; M144-E148 VanDerWaalsContact O-N 3.14Å; L145-E148 PolarHBondContact O-N 3.24Å; Y146-E148 VanDerWaalsContact C-N 3.33Å; Y146-E148 PolarHBondContact O-N 3.02Å; E148-L150 VanDerWaalsContact C-N 3.29Å; E148-L150 PolarHBondContact O-N 3.42Å; E148-N151 PolarHBondContact O-N 3.48Å; E148-L158 HydrophobicContact CB-CD1 4.34Å; E148-L158 HydrophobicContact CB-CD2 4.39Å; E148-L158 HydrophobicContact CB-CG 4.29Å; E148-L158 HydrophobicContact CG-CD2 3.8Å; E148-L158 HydrophobicContact CG-CG 4.06Å; E148-R166 IonicContact OE2-CZ 3.27Å; E148-R166 IonicContact OE2-NH1 2.67Å; E148-R166 PolarHBondContact OE2-NH1 3.19Å; E148-R166 IonicContact OE2-NH2 2.65Å; E148-R166 PolarHBondContact OE2-NH2 3.2Å; E148-R166 VanDerWaalsContact OE2-NH2 3.11Å
149	H	73.9	Confident	71.9	Confident	79 Å²	79	56.4 Å²	56.4	37%	0.366	28%	0.282	S	S	.	.	H	α-helix	trans	-65	-33.1	175.1	-173.9	76.4	0	0	0	112.5	L145 Y146 R147 N151 H156 L210	L145-H149 WeakPolarHBondContact O-CB 3.45Å; L145-H149 PolarHBondContact O-N 3.48Å; Y146-H149 WeakPolarHBondContact O-CB 3.4Å; Y146-H149 PolarHBondContact O-N 3.19Å; Y146-H149 VanDerWaalsContact O-N 3.17Å; R147-H149 VanDerWaalsContact C-N 3.33Å; H149-N151 VanDerWaalsContact C-N 3.34Å; H149-H156 AromaticContact ND1-ND1 3.94Å; H149-H156 PolarHBondContact O-ND1 2.95Å; H149-L210 HydrophobicContact CB-CD1 4.44Å; H149-L210 VanDerWaalsContact CD2-CD1 3.43Å; H149-L210 WeakPolarHBondContact CD2-CD1 3.41Å
150	L	70.6	Confident	71.7	Confident	104 Å²	104	60.3 Å²	60.3	55%	0.545	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.5	-9.4	178.4	-67.9	173.5	0	0	0	114.6	Y146 R147 E148 P152	Y146-L150 HydrophobicContact CD1-CD1 3.97Å; Y146-L150 HydrophobicContact CE1-CD1 3.57Å; Y146-L150 HydrophobicContact CE1-CG 4.37Å; Y146-L150 WeakPolarHBondContact O-CG 3.38Å; Y146-L150 PolarHBondContact O-N 3.12Å; Y146-L150 VanDerWaalsContact O-N 3.08Å; R147-L150 PolarHBondContact O-N 3.03Å; E148-L150 VanDerWaalsContact C-N 3.29Å; E148-L150 PolarHBondContact O-N 3.42Å; L150-P152 VanDerWaalsContact O-CD 3.32Å; L150-P152 WeakPolarHBondContact O-CD 3.48Å
151	N	71.5	Confident	71.5	Confident	77 Å²	77	63.2 Å²	63.2	41%	0.412	31%	0.309	S	S	.	.			trans	-80.7	116.2	179.2	-78.1	-25	0	0	0	110.7	E148 H149 N153 G154	E148-N151 PolarHBondContact O-N 3.48Å; H149-N151 VanDerWaalsContact C-N 3.34Å; N151-N153 PolarHBondContact O-N 2.85Å; N151-G154 PolarHBondContact O-N 3.37Å; N151-G154 VanDerWaalsContact O-N 3.13Å
152	P	53.1	Low	71.3	Confident	123 Å²	123	66.3 Å²	66.3	80%	0.799	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.4	-17.8	-176.8	25.1	-32.2	0	0	0	114.2	L150	L150-P152 VanDerWaalsContact O-CD 3.32Å; L150-P152 WeakPolarHBondContact O-CD 3.48Å
153	N	55.6	Low	71	Confident	163 Å²	163	66.7 Å²	66.7	87%	0.872	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.3	5.9	175.3	-70.2	-6.6	0	0	0	113.2	N151	N151-N153 PolarHBondContact O-N 2.85Å
154	G	58.7	Low	70.6	Confident	16 Å²	16	68.9 Å²	68.9	17%	0.165	34%	0.337	C	S	.	.	S	Bend	trans	-94	157	-177.3	0	0	0	0	0	112.6	N151 H156	N151-G154 PolarHBondContact O-N 3.37Å; N151-G154 VanDerWaalsContact O-N 3.13Å; G154-H156 PolarHBondContact O-N 3.43Å
155	Y	60.4	Low	70.2	Confident	186 Å²	186	74 Å²	74	73%	0.729	36%	0.361	S	S	*	.			trans	-81.3	10.6	-176.3	-64.4	-80	0	0	0	114.7	F157	Y155-F157 HydrophobicContact CD1-CE1 4.43Å; Y155-F157 HydrophobicContact CG-CE1 4.14Å; Y155-F157 HydrophobicContact CG-CZ 4.03Å; Y155-F157 WeakPolarHBondContact O-CD1 3.47Å; Y155-F157 WeakPolarHBondContact O-CE1 3.29Å; Y155-F157 PolarHBondContact O-N 3.38Å
156	H	67.9	Low	69.7	Low	94 Å²	94	77.9 Å²	77.9	44%	0.435	38%	0.375	S	S	.	.	S	Bend	trans	52.2	15.2	-177.4	-49	-72.8	0	0	0	115.7	H149 G154 S204	H149-H156 AromaticContact ND1-ND1 3.94Å; H149-H156 PolarHBondContact O-ND1 2.95Å; G154-H156 PolarHBondContact O-N 3.43Å; H156-S204 WeakPolarHBondContact O-CB 3.49Å
157	F	75.2	Confident	69	Low	40 Å²	40	77.3 Å²	77.3	18%	0.175	38%	0.375	C	S	.	.			trans	-139.4	156.2	175.5	66	-107	0	0	0	110.3	Y155 R202 Y203	Y155-F157 HydrophobicContact CD1-CE1 4.43Å; Y155-F157 HydrophobicContact CG-CE1 4.14Å; Y155-F157 HydrophobicContact CG-CZ 4.03Å; Y155-F157 WeakPolarHBondContact O-CD1 3.47Å; Y155-F157 WeakPolarHBondContact O-CE1 3.29Å; Y155-F157 PolarHBondContact O-N 3.38Å; F157-R202 HydrophobicContact CB-CB 4.1Å; F157-R202 HydrophobicContact CD2-CB 3.85Å; F157-R202 HydrophobicContact CD2-CG 3.61Å; F157-R202 HydrophobicContact CE2-CG 3.82Å; F157-R202 HydrophobicContact CG-CB 3.97Å; F157-R202 HydrophobicContact CG-CG 4.11Å; F157-R202 HydrophobicContact CZ-CG 4.44Å; F157-Y203 CarbonylContact C-O 3.57Å; F157-Y203 VanDerWaalsContact CA-O 3.31Å; F157-Y203 WeakPolarHBondContact CA-O 3.45Å
158	L	76.1	Confident	68.2	Low	2 Å²	2	76 Å²	76	1%	0.01	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	140.5	170.5	-64.9	175.6	0	0	0	111.2	L145 E148 E162 L163 Y203	L145-L158 HydrophobicContact CD2-CB 4.07Å; L145-L158 HydrophobicContact CD2-CD1 3.92Å; L145-L158 HydrophobicContact CD2-CG 4.06Å; E148-L158 HydrophobicContact CB-CD1 4.34Å; E148-L158 HydrophobicContact CB-CD2 4.39Å; E148-L158 HydrophobicContact CB-CG 4.29Å; E148-L158 HydrophobicContact CG-CD2 3.8Å; E148-L158 HydrophobicContact CG-CG 4.06Å; L158-E162 HydrophobicContact CD2-CB 4.31Å; L158-L163 HydrophobicContact CB-CD1 4.45Å; L158-L163 HydrophobicContact CB-CD2 4.04Å; L158-L163 HydrophobicContact CB-CG 3.83Å; L158-L163 HydrophobicContact CD1-CD2 3.67Å; L158-L163 HydrophobicContact CD1-CG 4.33Å; L158-Y203 PolarHBondContact N-O 2.77Å; L158-Y203 PolarHBondContact O-N 2.93Å
159	T	79.4	Confident	67.2	Low	27 Å²	27	81.6 Å²	81.6	17%	0.166	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	164.8	170.3	61.7	0	0	0	0	111.2	E161 E162 L163	T159-E161 PolarHBondContact O-N 3.21Å; T159-E162 WeakPolarHBondContact CB-OE2 3.25Å; T159-E162 WeakPolarHBondContact CG2-OE2 3.27Å; T159-E162 PolarHBondContact N-OE2 2.65Å; T159-E162 PolarHBondContact O-N 3.48Å; T159-E162 WeakPolarHBondContact OG1-CB 3.26Å; T159-E162 VanDerWaalsContact OG1-CG 3.22Å; T159-E162 WeakPolarHBondContact OG1-CG 3.27Å; T159-E162 PolarHBondContact OG1-N 2.8Å; T159-E162 PolarHBondContact OG1-OE2 3.5Å; T159-L163 WeakPolarHBondContact O-CG 3.39Å; T159-L163 PolarHBondContact O-N 2.88Å
160	K	70.8	Confident	66.3	Low	86 Å²	86	83.5 Å²	83.5	37%	0.374	42%	0.421	S	S	.	.	H	α-helix	trans	-56.6	-40.9	175	160.8	151.3	-168.6	-156.1	0	111.8	L164 W182 Y203	K160-L164 HydrophobicContact CG-CD1 4.28Å; K160-L164 WeakPolarHBondContact O-CG 3.48Å; K160-L164 PolarHBondContact O-N 2.86Å; K160-W182 HydrophobicContact CB-CH2 3.69Å; K160-W182 HydrophobicContact CB-CZ2 4.26Å; K160-W182 HydrophobicContact CD-CH2 3.41Å; K160-W182 VanDerWaalsContact CD-CH2 3.41Å; K160-W182 HydrophobicContact CD-CZ2 3.67Å; K160-W182 HydrophobicContact CD-CZ3 3.98Å; K160-W182 HydrophobicContact CG-CH2 3.28Å; K160-W182 HydrophobicContact CG-CZ2 3.43Å; K160-W182 VanDerWaalsContact CG-CZ2 3.43Å; K160-W182 HydrophobicContact CG-CZ3 4.29Å; K160-Y203 HydrophobicContact CB-CE2 4.13Å
161	E	69.2	Low	65.1	Low	122 Å²	122	81.6 Å²	81.6	57%	0.57	42%	0.421	S	S	*	.	H	α-helix	trans	-69.6	-44	-178	-68.5	65.8	-146.5	0	0	111	T159 L164 Q165	T159-E161 PolarHBondContact O-N 3.21Å; E161-L164 PolarHBondContact O-N 3.41Å; E161-Q165 WeakPolarHBondContact O-CB 3.25Å; E161-Q165 PolarHBondContact O-N 3.35Å
162	E	72.6	Confident	63.7	Low	69 Å²	69	83.6 Å²	83.6	32%	0.322	44%	0.438	S	S	.	.	H	α-helix	trans	-66.7	-39.2	177.5	-70.9	159.5	156	0	0	112.5	L158 T159 L164 Q165 R166	L158-E162 HydrophobicContact CD2-CB 4.31Å; T159-E162 WeakPolarHBondContact CB-OE2 3.25Å; T159-E162 WeakPolarHBondContact CG2-OE2 3.27Å; T159-E162 PolarHBondContact N-OE2 2.65Å; T159-E162 PolarHBondContact O-N 3.48Å; T159-E162 WeakPolarHBondContact OG1-CB 3.26Å; T159-E162 VanDerWaalsContact OG1-CG 3.22Å; T159-E162 WeakPolarHBondContact OG1-CG 3.27Å; T159-E162 PolarHBondContact OG1-N 2.8Å; T159-E162 PolarHBondContact OG1-OE2 3.5Å; E162-L164 VanDerWaalsContact C-N 3.33Å; E162-L164 PolarHBondContact O-N 2.93Å; E162-Q165 PolarHBondContact O-N 3.16Å; E162-R166 WeakPolarHBondContact O-CB 3.3Å; E162-R166 WeakPolarHBondContact O-CG 3.49Å; E162-R166 PolarHBondContact O-N 2.95Å
163	L	72.6	Confident	62.9	Low	8 Å²	8	88.9 Å²	88.9	4%	0.042	44%	0.442	C	S	.	.	H	α-helix	trans	-60.9	-42.5	173.6	-77	170.6	0	0	0	111.2	M144 L145 L158 T159 C167 Y203	M144-L163 HydrophobicContact CE-CD2 4.49Å; L145-L163 HydrophobicContact CD2-CD2 4.41Å; L158-L163 HydrophobicContact CB-CD1 4.45Å; L158-L163 HydrophobicContact CB-CD2 4.04Å; L158-L163 HydrophobicContact CB-CG 3.83Å; L158-L163 HydrophobicContact CD1-CD2 3.67Å; L158-L163 HydrophobicContact CD1-CG 4.33Å; T159-L163 WeakPolarHBondContact O-CG 3.39Å; T159-L163 PolarHBondContact O-N 2.88Å; L163-C167 VanDerWaalsContact O-CB 3.26Å; L163-C167 WeakPolarHBondContact O-CB 3.49Å; L163-C167 PolarHBondContact O-N 3.1Å; L163-C167 PolarHBondContact O-SG 3Å; L163-Y203 HydrophobicContact CD1-CD2 3.72Å; L163-Y203 HydrophobicContact CD1-CE2 4.46Å; L163-Y203 HydrophobicContact CD1-CG 4.12Å
164	L	68.4	Low	61.9	Low	67 Å²	67	86 Å²	86	35%	0.351	43%	0.43	S	S	.	.	H	α-helix	trans	-67	-45.4	178.6	-76.5	166.9	0	0	0	112.4	K160 E161 E162 C167 A168 W182	K160-L164 HydrophobicContact CG-CD1 4.28Å; K160-L164 WeakPolarHBondContact O-CG 3.48Å; K160-L164 PolarHBondContact O-N 2.86Å; E161-L164 PolarHBondContact O-N 3.41Å; E162-L164 VanDerWaalsContact C-N 3.33Å; E162-L164 PolarHBondContact O-N 2.93Å; L164-C167 PolarHBondContact O-N 3.36Å; L164-A168 PolarHBondContact O-N 3.17Å; L164-A168 VanDerWaalsContact O-N 3.07Å; L164-W182 HydrophobicContact CD1-CZ2 3.65Å; L164-W182 HydrophobicContact CD2-CZ2 3.96Å; L164-W182 HydrophobicContact CG-CZ2 3.64Å
165	Q	69.1	Low	60.5	Low	122 Å²	122	89 Å²	89	57%	0.57	45%	0.454	S	S	*	.	H	α-helix	trans	-62.6	-45.4	-179.2	-173.8	176.2	1.5	0	0	111.3	E161 E162 A168 Q169	E161-Q165 WeakPolarHBondContact O-CB 3.25Å; E161-Q165 PolarHBondContact O-N 3.35Å; E162-Q165 PolarHBondContact O-N 3.16Å; Q165-A168 PolarHBondContact O-N 3.46Å; Q165-Q169 WeakPolarHBondContact O-CG 3.46Å; Q165-Q169 PolarHBondContact O-N 3.39Å
166	R	67.5	Low	59.3	Low	88 Å²	88	86.9 Å²	86.9	33%	0.332	46%	0.462	S	S	.	.	H	α-helix	trans	-76.1	-28.7	-179.1	-65.6	-179.2	-174.1	177.5	0.9	113	M144 E148 E162 A168 Q169	M144-R166 HydrophobicContact CE-CB 3.22Å; M144-R166 HydrophobicContact CE-CG 4.39Å; E148-R166 IonicContact OE2-CZ 3.27Å; E148-R166 IonicContact OE2-NH1 2.67Å; E148-R166 PolarHBondContact OE2-NH1 3.19Å; E148-R166 IonicContact OE2-NH2 2.65Å; E148-R166 PolarHBondContact OE2-NH2 3.2Å; E148-R166 VanDerWaalsContact OE2-NH2 3.11Å; E162-R166 WeakPolarHBondContact O-CB 3.3Å; E162-R166 WeakPolarHBondContact O-CG 3.49Å; E162-R166 PolarHBondContact O-N 2.95Å; R166-A168 VanDerWaalsContact C-N 3.32Å; R166-Q169 PolarHBondContact O-N 3.15Å
167	C	63.1	Low	57.9	Low	22 Å²	22	86.1 Å²	86.1	15%	0.149	48%	0.48	C	S	.	.	H	α-helix	trans	-65	-35.7	169	-76.6	0	0	0	0	111.9	L163 L164 P181	L163-C167 VanDerWaalsContact O-CB 3.26Å; L163-C167 WeakPolarHBondContact O-CB 3.49Å; L163-C167 PolarHBondContact O-N 3.1Å; L163-C167 PolarHBondContact O-SG 3Å; L164-C167 PolarHBondContact O-N 3.36Å; C167-P181 HydrophobicContact CB-CG 4.46Å
168	A	59.4	Low	56.2	Low	81 Å²	81	89.5 Å²	89.5	67%	0.669	51%	0.509	S	S	*	.	H	α-helix	trans	-70.2	-34.3	177.6	0	0	0	0	0	112.8	L164 Q165 R166	L164-A168 PolarHBondContact O-N 3.17Å; L164-A168 VanDerWaalsContact O-N 3.07Å; Q165-A168 PolarHBondContact O-N 3.46Å; R166-A168 VanDerWaalsContact C-N 3.32Å
169	Q	57	Low	54.7	Low	138 Å²	138	92.6 Å²	92.6	65%	0.645	53%	0.534	S	S	*	.	H	α-helix	trans	-74.7	-21.6	-178.5	-74.3	172.6	-0.7	0	0	114.4	Q165 R166	Q165-Q169 WeakPolarHBondContact O-CG 3.46Å; Q165-Q169 PolarHBondContact O-N 3.39Å; R166-Q169 PolarHBondContact O-N 3.15Å
170	K	53.8	Low	53.5	Low	118 Å²	118	101.2 Å²	101.2	51%	0.513	56%	0.564	S	S	.	*	T	Hydrogen-bonded Turn	trans	-107.8	2.9	-169.1	-124.4	-179.9	-175.2	-179.3	0	115.8	P172	K170-P172 VanDerWaalsContact C-CD 3.49Å; K170-P172 WeakPolarHBondContact O-CD 3.36Å
171	A	46.4	Very low	52.8	Low	65 Å²	65	98.7 Å²	98.7	54%	0.537	56%	0.556	S	S	.	*			trans	-119.2	73.5	178.5	0	0	0	0	0	112.7	R173	A171-R173 VanDerWaalsContact C-N 3.3Å; A171-R173 PolarHBondContact O-N 3.36Å
172	P	41.5	Very low	52.6	Low	118 Å²	118	96 Å²	96	77%	0.766	54%	0.541	S	S	*	.	S	Bend	trans	-82.8	-0.4	173.3	-4.7	23.7	0	0	0	113.7	K170	K170-P172 VanDerWaalsContact C-CD 3.49Å; K170-P172 WeakPolarHBondContact O-CD 3.36Å
173	R	37.3	Very low	52.4	Low	235 Å²	235	96.5 Å²	96.5	89%	0.887	55%	0.55	S	S	*	*	S	Bend	trans	-142.8	61.2	-174.5	-65.9	-170.5	-178.9	-174.2	1	113.7	A171	A171-R173 VanDerWaalsContact C-N 3.3Å; A171-R173 PolarHBondContact O-N 3.36Å
174	V	34.3	Very low	52.1	Low	101 Å²	101	96.9 Å²	96.9	61%	0.612	55%	0.554	S	S	*	*	S	Bend	trans	-146.5	133	159.3	-173.9	0	0	0	0	108.3
175	A	29.2	Very low	52.4	Low	81 Å²	81	93.9 Å²	93.9	67%	0.669	54%	0.539	S	S	*	.			trans	-51.3	145.5	179.5	0	0	0	0	0	112.9	G177	A175-G177 PolarHBondContact O-N 3Å
176	P	34.8	Very low	52.3	Low	141 Å²	141	97.3 Å²	97.3	92%	0.916	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.3	91.3	-175.4	30	-32.1	0	0	0	109.9
177	G	38.7	Very low	52.5	Low	78 Å²	78	95.2 Å²	95.2	80%	0.804	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	-172.4	-29.6	178.1	0	0	0	0	0	118.9	A175	A175-G177 PolarHBondContact O-N 3Å
178	S	38.8	Very low	53.1	Low	111 Å²	111	94.2 Å²	94.2	78%	0.776	54%	0.538	S	S	*	.	S	Bend	trans	-124.5	-1.7	-164.8	85.3	0	0	0	0	119
179	A	44.9	Very low	53.8	Low	66 Å²	66	93.1 Å²	93.1	55%	0.545	52%	0.521	S	S	.	.			trans	-119.4	75.2	-179.7	0	0	0	0	0	112.8	P181	A179-P181 VanDerWaalsContact O-CD 3.31Å; A179-P181 WeakPolarHBondContact O-CD 3.32Å
180	R	53.7	Low	54.5	Low	208 Å²	208	94.9 Å²	94.9	79%	0.785	53%	0.529	S	S	*	.			trans	-73.7	119	161.7	-69.8	-171.1	-119.1	-167.4	-0.2	107.9	W182 P183	R180-W182 VanDerWaalsContact C-N 3.26Å; R180-W182 PolarHBondContact O-N 2.9Å; R180-P183 HydrophobicContact CB-CG 4.04Å; R180-P183 WeakPolarHBondContact O-CD 3.42Å
181	P	57.2	Low	55.5	Low	34 Å²	34	95.5 Å²	95.5	22%	0.221	53%	0.528	C	S	.	.	H	α-helix	trans	-67.7	-25.1	-176.8	-20.3	32.6	0	0	0	113.4	I141 C167 A179 A184 L185	I141-P181 HydrophobicContact CD1-CB 4.32Å; I141-P181 WeakPolarHBondContact CD1-O 3.45Å; C167-P181 HydrophobicContact CB-CG 4.46Å; A179-P181 VanDerWaalsContact O-CD 3.31Å; A179-P181 WeakPolarHBondContact O-CD 3.32Å; P181-A184 WeakPolarHBondContact O-CB 3.48Å; P181-A184 PolarHBondContact O-N 2.86Å; P181-L185 PolarHBondContact O-N 3.09Å
182	W	65.3	Low	56.9	Low	64 Å²	64	96.6 Å²	96.6	24%	0.242	53%	0.525	C	S	.	.	H	α-helix	trans	-72	-43.3	-172.1	-68.8	108.6	0	0	0	115.6	K160 L164 R180 A184 L185 R186 Y203	K160-W182 HydrophobicContact CB-CH2 3.69Å; K160-W182 HydrophobicContact CB-CZ2 4.26Å; K160-W182 HydrophobicContact CD-CH2 3.41Å; K160-W182 VanDerWaalsContact CD-CH2 3.41Å; K160-W182 HydrophobicContact CD-CZ2 3.67Å; K160-W182 HydrophobicContact CD-CZ3 3.98Å; K160-W182 HydrophobicContact CG-CH2 3.28Å; K160-W182 HydrophobicContact CG-CZ2 3.43Å; K160-W182 VanDerWaalsContact CG-CZ2 3.43Å; K160-W182 HydrophobicContact CG-CZ3 4.29Å; L164-W182 HydrophobicContact CD1-CZ2 3.65Å; L164-W182 HydrophobicContact CD2-CZ2 3.96Å; L164-W182 HydrophobicContact CG-CZ2 3.64Å; R180-W182 VanDerWaalsContact C-N 3.26Å; R180-W182 PolarHBondContact O-N 2.9Å; W182-A184 PolarHBondContact O-N 3.36Å; W182-L185 HydrophobicContact CE3-CB 4.45Å; W182-L185 HydrophobicContact CE3-CD2 3.73Å; W182-L185 HydrophobicContact CH2-CD2 4.06Å; W182-L185 HydrophobicContact CZ3-CD2 3.24Å; W182-L185 PolarHBondContact O-N 3.42Å; W182-R186 WeakPolarHBondContact O-CG 3.43Å; W182-R186 PolarHBondContact O-N 3.29Å; W182-Y203 HydrophobicContact CH2-CE2 4.49Å; W182-Y203 HydrophobicContact CZ3-CE2 4.46Å
183	P	67.7	Low	58.5	Low	80 Å²	80	91.8 Å²	91.8	52%	0.519	49%	0.493	S	S	.	.	H	α-helix	trans	-54.5	-38.6	167.7	-27.9	33.1	0	0	0	112.9	R180 S187	R180-P183 HydrophobicContact CB-CG 4.04Å; R180-P183 WeakPolarHBondContact O-CD 3.42Å; P183-S187 PolarHBondContact O-N 3.24Å; P183-S187 VanDerWaalsContact O-N 3.14Å
184	A	67.3	Low	60.4	Low	16 Å²	16	80.8 Å²	80.8	13%	0.132	45%	0.451	C	S	.	.	H	α-helix	trans	-68.6	-44.8	178	0	0	0	0	0	112.1	A138 I141 P181 W182 R186 S187 L188	A138-A184 HydrophobicContact CB-CB 4.09Å; I141-A184 HydrophobicContact CD1-CB 4.22Å; P181-A184 WeakPolarHBondContact O-CB 3.48Å; P181-A184 PolarHBondContact O-N 2.86Å; W182-A184 PolarHBondContact O-N 3.36Å; A184-R186 VanDerWaalsContact C-N 3.33Å; A184-R186 PolarHBondContact O-N 3.46Å; A184-S187 WeakPolarHBondContact O-CB 3.38Å; A184-S187 PolarHBondContact O-N 3.41Å; A184-S187 VanDerWaalsContact O-N 3.14Å; A184-L188 WeakPolarHBondContact O-CG 3.47Å; A184-L188 PolarHBondContact O-N 2.83Å
185	L	72.8	Confident	62.5	Low	4 Å²	4	79.4 Å²	79.4	2%	0.021	44%	0.44	C	S	.	.	H	α-helix	trans	-62	-38.5	176.1	-168.9	70.9	0	0	0	112.6	I141 P181 W182 S187 L188 L189 V194 Y203	I141-L185 HydrophobicContact CD1-CB 4.02Å; I141-L185 HydrophobicContact CD1-CD1 4.34Å; I141-L185 HydrophobicContact CG2-CD1 3.81Å; P181-L185 PolarHBondContact O-N 3.09Å; W182-L185 HydrophobicContact CE3-CB 4.45Å; W182-L185 HydrophobicContact CE3-CD2 3.73Å; W182-L185 HydrophobicContact CH2-CD2 4.06Å; W182-L185 HydrophobicContact CZ3-CD2 3.24Å; W182-L185 PolarHBondContact O-N 3.42Å; L185-S187 VanDerWaalsContact C-N 3.32Å; L185-S187 PolarHBondContact O-N 2.65Å; L185-L188 PolarHBondContact O-N 2.78Å; L185-L189 HydrophobicContact CG-CD1 4.35Å; L185-L189 WeakPolarHBondContact O-CG 3.41Å; L185-L189 PolarHBondContact O-N 3.38Å; L185-V194 HydrophobicContact CD1-CG1 4.11Å; L185-Y203 HydrophobicContact CD1-CD1 4.34Å; L185-Y203 HydrophobicContact CD2-CD1 3.95Å; L185-Y203 HydrophobicContact CD2-CD2 4.41Å; L185-Y203 HydrophobicContact CD2-CE1 3.62Å; L185-Y203 HydrophobicContact CD2-CE2 4.12Å; L185-Y203 HydrophobicContact CD2-CG 4.33Å; L185-Y203 HydrophobicContact CG-CD1 4.45Å; L185-Y203 HydrophobicContact CG-CE1 4.35Å
186	R	68.4	Low	65	Low	195 Å²	195	82.6 Å²	82.6	74%	0.736	44%	0.435	S	S	*	.	H	α-helix	trans	-62.8	-38.8	174.2	-74.8	-178.3	179.7	-176.4	0.4	112.1	W182 A184 H190	W182-R186 WeakPolarHBondContact O-CG 3.43Å; W182-R186 PolarHBondContact O-N 3.29Å; A184-R186 VanDerWaalsContact C-N 3.33Å; A184-R186 PolarHBondContact O-N 3.46Å; R186-H190 WeakPolarHBondContact O-CB 3.38Å; R186-H190 PolarHBondContact O-N 2.92Å
187	S	71.1	Confident	66.6	Low	44 Å²	44	78.6 Å²	78.6	31%	0.308	41%	0.408	S	S	.	.	H	α-helix	trans	-65.9	-40.6	175.2	-165.8	0	0	0	0	111.5	P183 A184 L185 H190 R191	P183-S187 PolarHBondContact O-N 3.24Å; P183-S187 VanDerWaalsContact O-N 3.14Å; A184-S187 WeakPolarHBondContact O-CB 3.38Å; A184-S187 PolarHBondContact O-N 3.41Å; A184-S187 VanDerWaalsContact O-N 3.14Å; L185-S187 VanDerWaalsContact C-N 3.32Å; L185-S187 PolarHBondContact O-N 2.65Å; S187-H190 PolarHBondContact O-N 2.86Å; S187-R191 WeakPolarHBondContact O-CB 3.31Å; S187-R191 VanDerWaalsContact O-CG 3.23Å; S187-R191 WeakPolarHBondContact O-CG 3.41Å; S187-R191 PolarHBondContact O-N 3.32Å; S187-R191 PolarHBondContact OG-NE 3.33Å
188	L	75.3	Confident	67.5	Low	0 Å²	0	81.3 Å²	81.3	0%	0	40%	0.4	C	S	.	.	H	α-helix	trans	-66.6	-39.1	176.5	-68	174.6	0	0	0	112.9	Y130 A138 I141 L142 A184 L185 R191 N192 L193 V194	Y130-L188 HydrophobicContact CE1-CD2 4.06Å; A138-L188 HydrophobicContact CB-CD1 4.26Å; A138-L188 HydrophobicContact CB-CD2 4.19Å; A138-L188 HydrophobicContact CB-CG 4.24Å; I141-L188 HydrophobicContact CB-CD1 4.03Å; I141-L188 HydrophobicContact CG2-CD1 3.79Å; L142-L188 HydrophobicContact CD1-CD2 4.07Å; L142-L188 HydrophobicContact CD2-CD1 4.41Å; L142-L188 HydrophobicContact CD2-CD2 4.3Å; L142-L188 HydrophobicContact CG-CD1 4.18Å; L142-L188 HydrophobicContact CG-CD2 4.21Å; A184-L188 WeakPolarHBondContact O-CG 3.47Å; A184-L188 PolarHBondContact O-N 2.83Å; L185-L188 PolarHBondContact O-N 2.78Å; L188-R191 CarbonylContact O-C 3.6Å; L188-R191 PolarHBondContact O-N 2.93Å; L188-N192 PolarHBondContact O-N 3.49Å; L188-L193 HydrophobicContact CD2-CB 4.14Å; L188-L193 HydrophobicContact CD2-CD1 3.75Å; L188-L193 PolarHBondContact O-N 2.78Å; L188-V194 HydrophobicContact CB-CB 4.32Å; L188-V194 HydrophobicContact CB-CG2 3.89Å; L188-V194 HydrophobicContact CD1-CG2 4.12Å
189	L	75.6	Confident	67.9	Low	59 Å²	59	84.8 Å²	84.8	31%	0.309	40%	0.404	S	S	.	.	H	α-helix	trans	-63.4	-43.5	172.5	-74.8	160.9	0	0	0	111.6	L185 R191 N192 V194 R196 Y203	L185-L189 HydrophobicContact CG-CD1 4.35Å; L185-L189 WeakPolarHBondContact O-CG 3.41Å; L185-L189 PolarHBondContact O-N 3.38Å; L189-R191 PolarHBondContact O-N 2.9Å; L189-N192 PolarHBondContact O-N 2.85Å; L189-V194 HydrophobicContact CD2-CG1 4.48Å; L189-V194 VanDerWaalsContact CD2-O 3.3Å; L189-V194 WeakPolarHBondContact CD2-O 3.42Å; L189-R196 HydrophobicContact CD2-CB 3.92Å; L189-Y203 HydrophobicContact CD1-CE1 4.18Å
190	H	71.3	Confident	68.3	Low	175 Å²	175	86.3 Å²	86.3	81%	0.81	41%	0.408	S	S	*	.	H	α-helix	trans	-68.1	-24.6	177.7	-169.6	-71.4	0	0	0	112.7	R186 S187	R186-H190 WeakPolarHBondContact O-CB 3.38Å; R186-H190 PolarHBondContact O-N 2.92Å; S187-H190 PolarHBondContact O-N 2.86Å
191	R	73.4	Confident	69.3	Low	130 Å²	130	77.2 Å²	77.2	49%	0.491	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.6	4.3	177.7	-70.3	172.5	-176.1	-104	-0.9	113.6	S187 L188 L189 L193	S187-R191 WeakPolarHBondContact O-CB 3.31Å; S187-R191 VanDerWaalsContact O-CG 3.23Å; S187-R191 WeakPolarHBondContact O-CG 3.41Å; S187-R191 PolarHBondContact O-N 3.32Å; S187-R191 PolarHBondContact OG-NE 3.33Å; L188-R191 CarbonylContact O-C 3.6Å; L188-R191 PolarHBondContact O-N 2.93Å; L189-R191 PolarHBondContact O-N 2.9Å; R191-L193 VanDerWaalsContact C-N 3.29Å; R191-L193 HydrophobicContact CB-CD1 4.07Å; R191-L193 HydrophobicContact CB-CG 4.18Å; R191-L193 PolarHBondContact O-N 3.46Å
192	N	75.8	Confident	70.4	Confident	89 Å²	89	79.8 Å²	79.8	48%	0.476	38%	0.383	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.4	36.3	-178.2	-158.2	24.2	0	0	0	114.2	L188 L189 T206	L188-N192 PolarHBondContact O-N 3.49Å; L189-N192 PolarHBondContact O-N 2.85Å; N192-T206 WeakPolarHBondContact O-CG2 3.38Å; N192-T206 PolarHBondContact O-OG1 3.4Å
193	L	75.6	Confident	71.1	Confident	17 Å²	17	77.5 Å²	77.5	9%	0.089	37%	0.374	C	S	.	.	S	Bend	trans	-101.9	-15	176.9	-62.9	171	0	0	0	112.6	Y130 L142 L188 R191 T206 E208 G209 L212	Y130-L193 HydrophobicContact CD1-CD1 3.47Å; Y130-L193 VanDerWaalsContact CD1-CD1 3.47Å; Y130-L193 HydrophobicContact CE1-CD1 3.62Å; L142-L193 HydrophobicContact CD2-CB 4.41Å; L188-L193 HydrophobicContact CD2-CB 4.14Å; L188-L193 HydrophobicContact CD2-CD1 3.75Å; L188-L193 PolarHBondContact O-N 2.78Å; R191-L193 VanDerWaalsContact C-N 3.29Å; R191-L193 HydrophobicContact CB-CD1 4.07Å; R191-L193 HydrophobicContact CB-CG 4.18Å; R191-L193 PolarHBondContact O-N 3.46Å; L193-T206 VanDerWaalsContact CA-OG1 3.3Å; L193-T206 WeakPolarHBondContact CA-OG1 3.25Å; L193-T206 PolarHBondContact O-N 2.95Å; L193-T206 PolarHBondContact O-OG1 3.14Å; L193-E208 HydrophobicContact CD2-CB 4.37Å; L193-G209 WeakPolarHBondContact O-CA 3.35Å; L193-L212 HydrophobicContact CD1-CD2 3.89Å; L193-L212 HydrophobicContact CD2-CD2 4.17Å
194	V	78.1	Confident	71.8	Confident	3 Å²	3	74.9 Å²	74.9	2%	0.018	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	136.8	178.5	175.7	0	0	0	0	107.8	L142 L145 L185 L188 L189 Y203 S204 L205	L142-V194 HydrophobicContact CD2-CG2 4.46Å; L145-V194 HydrophobicContact CD1-CG1 4.11Å; L145-V194 HydrophobicContact CD1-CG2 3.84Å; L185-V194 HydrophobicContact CD1-CG1 4.11Å; L188-V194 HydrophobicContact CB-CB 4.32Å; L188-V194 HydrophobicContact CB-CG2 3.89Å; L188-V194 HydrophobicContact CD1-CG2 4.12Å; L189-V194 HydrophobicContact CD2-CG1 4.48Å; L189-V194 VanDerWaalsContact CD2-O 3.3Å; L189-V194 WeakPolarHBondContact CD2-O 3.42Å; V194-Y203 HydrophobicContact CG1-CD1 4.15Å; V194-S204 CarbonylContact C-O 3.58Å; V194-S204 WeakPolarHBondContact CA-O 3.49Å; V194-S204 WeakPolarHBondContact CG1-O 3.4Å; V194-L205 HydrophobicContact CG2-CD2 4.33Å
195	L	78.3	Confident	72.5	Confident	73 Å²	73	75.3 Å²	75.3	38%	0.382	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	149.1	174.5	-74.1	153.7	0	0	0	110.2	Y203 S204 T206	L195-Y203 VanDerWaalsContact O-CA 3.29Å; L195-Y203 WeakPolarHBondContact O-CA 3.26Å; L195-S204 PolarHBondContact N-O 3.49Å; L195-S204 PolarHBondContact O-N 2.87Å; L195-T206 HydrophobicContact CD1-CG2 3.61Å; L195-T206 HydrophobicContact CD2-CG2 4.12Å; L195-T206 HydrophobicContact CG-CG2 3.44Å; L195-T206 VanDerWaalsContact CG-CG2 3.44Å
196	R	81.5	Confident	72.9	Confident	148 Å²	148	75.3 Å²	75.3	56%	0.558	36%	0.358	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.4	118.3	169.1	-179.9	-175.8	169.2	-170.8	-2.2	109.2	L189 A201 R202 Y203	L189-R196 HydrophobicContact CD2-CB 3.92Å; R196-A201 HydrophobicContact CG-CB 4.1Å; R196-A201 VanDerWaalsContact NE-CB 3.3Å; R196-R202 CarbonylContact C-O 3.59Å; R196-R202 WeakPolarHBondContact CA-O 3.28Å; R196-Y203 HydrophobicContact CB-CD1 4.18Å; R196-Y203 HydrophobicContact CB-CE1 4.03Å; R196-Y203 HydrophobicContact CG-CD1 4.4Å; R196-Y203 HydrophobicContact CG-CE1 3.96Å
197	T	69.1	Low	73.3	Confident	57 Å²	57	70.5 Å²	70.5	35%	0.35	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	154.8	178.7	59.1	0	0	0	0	111	R202	T197-R202 PolarHBondContact N-O 3.09Å; T197-R202 PolarHBondContact O-N 2.66Å
198	H	56.5	Low	73.5	Confident	135 Å²	135	73.4 Å²	73.4	63%	0.625	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	61	171.1	174.9	-58.9	-83.3	0	0	0	118.5	P200	H198-P200 CarbonylContact C-O 3.51Å; H198-P200 VanDerWaalsContact C-O 3.32Å
199	Q	47.3	Very low	73.7	Confident	184 Å²	184	73.4 Å²	73.4	86%	0.86	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-127.4	113.2	163.7	-100.9	174.2	-55.2	0	0	107.6
200	P	54	Low	74	Confident	98 Å²	98	72.7 Å²	72.7	64%	0.636	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	cis	-66.1	154.4	5.2	27.9	-34.5	0	0	0	114	H198 R202	H198-P200 CarbonylContact C-O 3.51Å; H198-P200 VanDerWaalsContact C-O 3.32Å; P200-R202 PolarHBondContact O-N 3.28Å
201	A	75	Confident	74.4	Confident	17 Å²	17	69.9 Å²	69.9	14%	0.14	34%	0.344	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71	121.6	-170.6	0	0	0	0	0	112.3	R196 Y203	R196-A201 HydrophobicContact CG-CB 4.1Å; R196-A201 VanDerWaalsContact NE-CB 3.3Å; A201-Y203 HydrophobicContact CB-CE2 4.29Å
202	R	79.9	Confident	74.7	Confident	88 Å²	88	64.5 Å²	64.5	33%	0.332	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	135.6	174.7	-64.9	176.6	176.6	-178.1	-2.5	109.5	F157 R196 T197 P200	F157-R202 HydrophobicContact CB-CB 4.1Å; F157-R202 HydrophobicContact CD2-CB 3.85Å; F157-R202 HydrophobicContact CD2-CG 3.61Å; F157-R202 HydrophobicContact CE2-CG 3.82Å; F157-R202 HydrophobicContact CG-CB 3.97Å; F157-R202 HydrophobicContact CG-CG 4.11Å; F157-R202 HydrophobicContact CZ-CG 4.44Å; R196-R202 CarbonylContact C-O 3.59Å; R196-R202 WeakPolarHBondContact CA-O 3.28Å; T197-R202 PolarHBondContact N-O 3.09Å; T197-R202 PolarHBondContact O-N 2.66Å; P200-R202 PolarHBondContact O-N 3.28Å
203	Y	79.8	Confident	75.1	Confident	15 Å²	15	60.3 Å²	60.3	6%	0.059	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	128.2	-179.8	-59.5	-81.3	0	0	0	110.4	L145 F157 L158 K160 L163 W182 L185 L189 V194 L195 R196 A201	L145-Y203 WeakPolarHBondContact CD2-O 3.41Å; F157-Y203 CarbonylContact C-O 3.57Å; F157-Y203 VanDerWaalsContact CA-O 3.31Å; F157-Y203 WeakPolarHBondContact CA-O 3.45Å; L158-Y203 PolarHBondContact N-O 2.77Å; L158-Y203 PolarHBondContact O-N 2.93Å; K160-Y203 HydrophobicContact CB-CE2 4.13Å; L163-Y203 HydrophobicContact CD1-CD2 3.72Å; L163-Y203 HydrophobicContact CD1-CE2 4.46Å; L163-Y203 HydrophobicContact CD1-CG 4.12Å; W182-Y203 HydrophobicContact CH2-CE2 4.49Å; W182-Y203 HydrophobicContact CZ3-CE2 4.46Å; L185-Y203 HydrophobicContact CD1-CD1 4.34Å; L185-Y203 HydrophobicContact CD2-CD1 3.95Å; L185-Y203 HydrophobicContact CD2-CD2 4.41Å; L185-Y203 HydrophobicContact CD2-CE1 3.62Å; L185-Y203 HydrophobicContact CD2-CE2 4.12Å; L185-Y203 HydrophobicContact CD2-CG 4.33Å; L185-Y203 HydrophobicContact CG-CD1 4.45Å; L185-Y203 HydrophobicContact CG-CE1 4.35Å; L189-Y203 HydrophobicContact CD1-CE1 4.18Å; V194-Y203 HydrophobicContact CG1-CD1 4.15Å; L195-Y203 VanDerWaalsContact O-CA 3.29Å; L195-Y203 WeakPolarHBondContact O-CA 3.26Å; R196-Y203 HydrophobicContact CB-CD1 4.18Å; R196-Y203 HydrophobicContact CB-CE1 4.03Å; R196-Y203 HydrophobicContact CG-CD1 4.4Å; R196-Y203 HydrophobicContact CG-CE1 3.96Å; A201-Y203 HydrophobicContact CB-CE2 4.29Å
204	S	81.6	Confident	75.3	Confident	25 Å²	25	63.3 Å²	63.3	18%	0.175	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	161.4	177.7	60.4	0	0	0	0	110.4	H156 V194 L195	H156-S204 WeakPolarHBondContact O-CB 3.49Å; V194-S204 CarbonylContact C-O 3.58Å; V194-S204 WeakPolarHBondContact CA-O 3.49Å; V194-S204 WeakPolarHBondContact CG1-O 3.4Å; L195-S204 PolarHBondContact N-O 3.49Å; L195-S204 PolarHBondContact O-N 2.87Å
205	L	82.4	Confident	75.4	Confident	25 Å²	25	68.1 Å²	68.1	13%	0.131	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	144.5	175.3	-68.1	168.5	0	0	0	110.6	L142 L145 V194 L210 A213	L142-L205 HydrophobicContact CD2-CD2 3.6Å; L145-L205 HydrophobicContact CB-CD1 3.9Å; L145-L205 HydrophobicContact CB-CD2 3.94Å; L145-L205 HydrophobicContact CB-CG 3.64Å; L145-L205 HydrophobicContact CD1-CD2 4Å; L145-L205 HydrophobicContact CD1-CG 4.31Å; V194-L205 HydrophobicContact CG2-CD2 4.33Å; L205-L210 HydrophobicContact CB-CB 4.5Å; L205-L210 HydrophobicContact CD1-CD1 3.97Å; L205-A213 HydrophobicContact CD1-CB 4.18Å
206	T	80.7	Confident	75.5	Confident	4 Å²	4	64.6 Å²	64.6	3%	0.025	32%	0.318	C	S	.	.			trans	-76.2	165.4	160.6	52.7	0	0	0	0	109.9	N192 L193 L195 E208 G209 L210	N192-T206 WeakPolarHBondContact O-CG2 3.38Å; N192-T206 PolarHBondContact O-OG1 3.4Å; L193-T206 VanDerWaalsContact CA-OG1 3.3Å; L193-T206 WeakPolarHBondContact CA-OG1 3.25Å; L193-T206 PolarHBondContact O-N 2.95Å; L193-T206 PolarHBondContact O-OG1 3.14Å; L195-T206 HydrophobicContact CD1-CG2 3.61Å; L195-T206 HydrophobicContact CD2-CG2 4.12Å; L195-T206 HydrophobicContact CG-CG2 3.44Å; L195-T206 VanDerWaalsContact CG-CG2 3.44Å; T206-E208 WeakPolarHBondContact CB-OE2 3.4Å; T206-E208 PolarHBondContact O-N 2.79Å; T206-E208 PolarHBondContact OG1-OE2 3.05Å; T206-G209 CarbonylContact O-C 3.48Å; T206-G209 WeakPolarHBondContact O-CA 3.46Å; T206-G209 PolarHBondContact O-N 2.98Å; T206-G209 VanDerWaalsContact O-N 3.08Å; T206-G209 PolarHBondContact OG1-N 3.46Å; T206-L210 WeakPolarHBondContact O-CB 3.33Å; T206-L210 PolarHBondContact O-N 2.83Å
207	P	76.4	Confident	75.2	Confident	94 Å²	94	58 Å²	58	61%	0.61	30%	0.295	S	S	*	.	H	α-helix	trans	-52.4	-42.8	170.1	-26.5	36	0	0	0	112.8	G209 L210 E211	P207-G209 PolarHBondContact O-N 2.86Å; P207-L210 WeakPolarHBondContact O-CB 3.47Å; P207-L210 PolarHBondContact O-N 3.18Å; P207-E211 PolarHBondContact O-N 3.17Å; P207-E211 VanDerWaalsContact O-N 3.14Å
208	E	75.9	Confident	75.5	Confident	105 Å²	105	60.2 Å²	60.2	49%	0.491	30%	0.301	S	S	.	.	H	α-helix	trans	-68.2	-35.4	177.2	-56.7	84.4	173.3	0	0	112.3	L193 T206 L210 L212	L193-E208 HydrophobicContact CD2-CB 4.37Å; T206-E208 WeakPolarHBondContact CB-OE2 3.4Å; T206-E208 PolarHBondContact O-N 2.79Å; T206-E208 PolarHBondContact OG1-OE2 3.05Å; E208-L210 VanDerWaalsContact C-N 3.35Å; E208-L212 PolarHBondContact O-N 3.45Å
209	G	80.4	Confident	75.9	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-67.7	-33.8	173.7	0	0	0	0	0	113.2	L193 T206 P207 A213	L193-G209 WeakPolarHBondContact O-CA 3.35Å; T206-G209 CarbonylContact O-C 3.48Å; T206-G209 WeakPolarHBondContact O-CA 3.46Å; T206-G209 PolarHBondContact O-N 2.98Å; T206-G209 VanDerWaalsContact O-N 3.08Å; T206-G209 PolarHBondContact OG1-N 3.46Å; P207-G209 PolarHBondContact O-N 2.86Å; G209-A213 VanDerWaalsContact O-CB 3.22Å; G209-A213 WeakPolarHBondContact O-CB 3.44Å; G209-A213 PolarHBondContact O-N 3.05Å
210	L	80.6	Confident	76.7	Confident	45 Å²	45	51.4 Å²	51.4	24%	0.236	27%	0.267	C	S	.	.	H	α-helix	trans	-69.8	-47.8	178.4	-172	73.1	0	0	0	111.4	Y146 H149 L205 T206 P207 E208 L212 A213 Q214	Y146-L210 HydrophobicContact CD2-CD1 3.72Å; Y146-L210 HydrophobicContact CE2-CD1 3.99Å; H149-L210 HydrophobicContact CB-CD1 4.44Å; H149-L210 VanDerWaalsContact CD2-CD1 3.43Å; H149-L210 WeakPolarHBondContact CD2-CD1 3.41Å; L205-L210 HydrophobicContact CB-CB 4.5Å; L205-L210 HydrophobicContact CD1-CD1 3.97Å; T206-L210 WeakPolarHBondContact O-CB 3.33Å; T206-L210 PolarHBondContact O-N 2.83Å; P207-L210 WeakPolarHBondContact O-CB 3.47Å; P207-L210 PolarHBondContact O-N 3.18Å; E208-L210 VanDerWaalsContact C-N 3.35Å; L210-L212 VanDerWaalsContact C-N 3.31Å; L210-L212 PolarHBondContact O-N 2.95Å; L210-A213 PolarHBondContact O-N 3.2Å; L210-Q214 WeakPolarHBondContact O-CB 3.45Å; L210-Q214 PolarHBondContact O-N 3.27Å
211	E	79.3	Confident	76.6	Confident	115 Å²	115	49.9 Å²	49.9	54%	0.537	27%	0.269	S	S	.	.	H	α-helix	trans	-59.2	-42.7	175.9	-73.5	-172.6	-172.7	0	0	112.1	P207 K215	P207-E211 PolarHBondContact O-N 3.17Å; P207-E211 VanDerWaalsContact O-N 3.14Å; E211-K215 VanDerWaalsContact O-CG 3.32Å; E211-K215 WeakPolarHBondContact O-CG 3.41Å; E211-K215 PolarHBondContact O-N 3.07Å; E211-K215 IonicContact OE2-NZ 3.68Å
212	L	81.5	Confident	75.5	Confident	18 Å²	18	53.5 Å²	53.5	9%	0.094	29%	0.285	C	S	.	.	H	α-helix	trans	-66	-43.6	177	-179.5	62.4	0	0	0	111	Y130 W131 L142 L193 E208 L210 Q214 K215 L216	Y130-L212 HydrophobicContact CD1-CD2 3.8Å; Y130-L212 HydrophobicContact CE1-CD2 4.36Å; Y130-L212 VanDerWaalsContact O-CD1 3.26Å; Y130-L212 WeakPolarHBondContact O-CD1 3.37Å; Y130-L212 WeakPolarHBondContact O-CD2 3.35Å; W131-L212 HydrophobicContact CE3-CD1 4.26Å; L142-L212 HydrophobicContact CD1-CD2 3.95Å; L142-L212 HydrophobicContact CD1-CG 4.42Å; L193-L212 HydrophobicContact CD1-CD2 3.89Å; L193-L212 HydrophobicContact CD2-CD2 4.17Å; E208-L212 PolarHBondContact O-N 3.45Å; L210-L212 VanDerWaalsContact C-N 3.31Å; L210-L212 PolarHBondContact O-N 2.95Å; L212-Q214 VanDerWaalsContact C-N 3.33Å; L212-Q214 PolarHBondContact O-N 3.22Å; L212-K215 PolarHBondContact O-N 3.46Å; L212-L216 HydrophobicContact CD1-CD1 4.34Å; L212-L216 HydrophobicContact CD1-CG 4.43Å; L212-L216 HydrophobicContact CG-CD1 3.97Å; L212-L216 WeakPolarHBondContact O-CB 3.37Å; L212-L216 WeakPolarHBondContact O-CD1 3.46Å; L212-L216 WeakPolarHBondContact O-CG 3.34Å; L212-L216 PolarHBondContact O-N 3.18Å
213	A	83.3	Confident	73.4	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-65.8	-35.5	179.3	0	0	0	0	0	112.6	L142 Y146 L205 G209 L210 L216 A217	L142-A213 HydrophobicContact CB-CB 4.18Å; Y146-A213 HydrophobicContact CD2-CB 4.06Å; Y146-A213 HydrophobicContact CG-CB 4.08Å; L205-A213 HydrophobicContact CD1-CB 4.18Å; G209-A213 VanDerWaalsContact O-CB 3.22Å; G209-A213 WeakPolarHBondContact O-CB 3.44Å; G209-A213 PolarHBondContact O-N 3.05Å; L210-A213 PolarHBondContact O-N 3.2Å; A213-L216 PolarHBondContact O-N 3.45Å; A213-A217 WeakPolarHBondContact O-CB 3.48Å; A213-A217 PolarHBondContact O-N 3.35Å
214	Q	80.2	Confident	71.4	Confident	81 Å²	81	59.7 Å²	59.7	38%	0.379	33%	0.332	S	S	.	.	H	α-helix	trans	-63.8	-51.4	173.4	178.8	175.2	-6.4	0	0	111.5	Y146 L210 L212 L216 A217 E218	Y146-Q214 HydrophobicContact CE2-CB 3.88Å; L210-Q214 WeakPolarHBondContact O-CB 3.45Å; L210-Q214 PolarHBondContact O-N 3.27Å; L212-Q214 VanDerWaalsContact C-N 3.33Å; L212-Q214 PolarHBondContact O-N 3.22Å; Q214-L216 PolarHBondContact O-N 2.88Å; Q214-A217 PolarHBondContact O-N 2.85Å; Q214-E218 VanDerWaalsContact CG-OE1 3.27Å; Q214-E218 WeakPolarHBondContact CG-OE1 3.46Å; Q214-E218 PolarHBondContact NE2-OE1 2.91Å; Q214-E218 WeakPolarHBondContact O-CG 3.43Å; Q214-E218 PolarHBondContact O-N 3.36Å
215	K	79.9	Confident	69	Low	103 Å²	103	67 Å²	67	45%	0.448	37%	0.368	S	S	.	.	H	α-helix	trans	-57.6	-35.7	175.7	-70.6	168.2	-176.9	164.2	0	112	W131 E211 L212 S219	W131-K215 HydrophobicContact CZ3-CB 4.13Å; E211-K215 VanDerWaalsContact O-CG 3.32Å; E211-K215 WeakPolarHBondContact O-CG 3.41Å; E211-K215 PolarHBondContact O-N 3.07Å; E211-K215 IonicContact OE2-NZ 3.68Å; L212-K215 PolarHBondContact O-N 3.46Å; K215-S219 WeakPolarHBondContact O-CB 3.47Å; K215-S219 PolarHBondContact O-N 3.12Å; K215-S219 VanDerWaalsContact O-N 3.13Å
216	L	79.8	Confident	66.5	Low	0 Å²	0	72.7 Å²	72.7	0%	0	40%	0.398	C	S	.	.	H	α-helix	trans	-69.4	-40.8	175.6	-69.9	166.9	0	0	0	112.3	W131 P132 R139 L142 L143 L212 A213 Q214 S219 E220	W131-L216 HydrophobicContact CD2-CD2 3.83Å; W131-L216 HydrophobicContact CE3-CD2 3.87Å; W131-L216 HydrophobicContact CH2-CD2 3.63Å; W131-L216 HydrophobicContact CH2-CG 4.24Å; W131-L216 HydrophobicContact CZ2-CD2 3.57Å; W131-L216 HydrophobicContact CZ3-CD2 3.77Å; W131-L216 HydrophobicContact CZ3-CG 4.18Å; P132-L216 HydrophobicContact CG-CD1 4.06Å; R139-L216 HydrophobicContact CG-CD2 4.45Å; R139-L216 VanDerWaalsContact CZ-CD2 3.42Å; L142-L216 HydrophobicContact CB-CD1 4.46Å; L142-L216 HydrophobicContact CD1-CD1 3.93Å; L143-L216 HydrophobicContact CD2-CB 4.18Å; L212-L216 HydrophobicContact CD1-CD1 4.34Å; L212-L216 HydrophobicContact CD1-CG 4.43Å; L212-L216 HydrophobicContact CG-CD1 3.97Å; L212-L216 WeakPolarHBondContact O-CB 3.37Å; L212-L216 WeakPolarHBondContact O-CD1 3.46Å; L212-L216 WeakPolarHBondContact O-CG 3.34Å; L212-L216 PolarHBondContact O-N 3.18Å; A213-L216 PolarHBondContact O-N 3.45Å; Q214-L216 PolarHBondContact O-N 2.88Å; L216-S219 PolarHBondContact O-N 2.96Å; L216-S219 PolarHBondContact O-OG 2.95Å; L216-E220 PolarHBondContact O-N 3.14Å
217	A	75.8	Confident	64.1	Low	8 Å²	8	79.4 Å²	79.4	7%	0.066	44%	0.439	C	S	.	.	H	α-helix	trans	-67.4	-40.5	178.1	0	0	0	0	0	112.2	L143 Y146 A213 Q214 S219 E220 G221 L222	L143-A217 HydrophobicContact CD2-CB 3.96Å; Y146-A217 HydrophobicContact CD1-CB 4Å; Y146-A217 HydrophobicContact CE1-CB 3.76Å; A213-A217 WeakPolarHBondContact O-CB 3.48Å; A213-A217 PolarHBondContact O-N 3.35Å; Q214-A217 PolarHBondContact O-N 2.85Å; A217-S219 VanDerWaalsContact C-N 3.34Å; A217-E220 PolarHBondContact O-N 3.2Å; A217-G221 PolarHBondContact O-N 3.31Å; A217-L222 PolarHBondContact O-N 2.74Å
218	E	74.2	Confident	61.8	Low	104 Å²	104	78 Å²	78	49%	0.486	44%	0.441	S	S	.	.	H	α-helix	trans	-62.7	-40.2	174	-70.4	167	-174.5	0	0	111.2	Q214 E220 G221	Q214-E218 VanDerWaalsContact CG-OE1 3.27Å; Q214-E218 WeakPolarHBondContact CG-OE1 3.46Å; Q214-E218 PolarHBondContact NE2-OE1 2.91Å; Q214-E218 WeakPolarHBondContact O-CG 3.43Å; Q214-E218 PolarHBondContact O-N 3.36Å; E218-E220 PolarHBondContact O-N 3.21Å; E218-G221 PolarHBondContact O-N 3.48Å
219	S	65.9	Low	59.5	Low	56 Å²	56	81.5 Å²	81.5	39%	0.392	46%	0.462	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-15	176.4	78.2	0	0	0	0	114.9	W131 R139 K215 L216 A217	W131-S219 WeakPolarHBondContact CZ2-OG 3.43Å; R139-S219 PolarHBondContact NH2-OG 3.26Å; R139-S219 VanDerWaalsContact NH2-OG 3.1Å; K215-S219 WeakPolarHBondContact O-CB 3.47Å; K215-S219 PolarHBondContact O-N 3.12Å; K215-S219 VanDerWaalsContact O-N 3.13Å; L216-S219 PolarHBondContact O-N 2.96Å; L216-S219 PolarHBondContact O-OG 2.95Å; A217-S219 VanDerWaalsContact C-N 3.34Å
220	E	64	Low	56.8	Low	79 Å²	79	84.6 Å²	84.6	37%	0.369	49%	0.494	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.9	2.5	178.7	-75.1	-179.1	-165.1	0	0	113.2	R139 L143 L216 A217 E218 L222	R139-E220 IonicContact CZ-OE1 2.66Å; R139-E220 VanDerWaalsContact CZ-OE1 3.26Å; R139-E220 IonicContact NE-OE1 3.62Å; R139-E220 PolarHBondContact NE-OE1 3.28Å; R139-E220 IonicContact NH2-OE1 3.88Å; R139-E220 PolarHBondContact NH2-OE1 3.15Å; L143-E220 VanDerWaalsContact CD1-OE2 3.3Å; L143-E220 WeakPolarHBondContact CD1-OE2 3.44Å; L216-E220 PolarHBondContact O-N 3.14Å; A217-E220 PolarHBondContact O-N 3.2Å; E218-E220 PolarHBondContact O-N 3.21Å; E220-L222 VanDerWaalsContact C-N 3.26Å; E220-L222 HydrophobicContact CB-CD1 4.13Å; E220-L222 HydrophobicContact CB-CG 4.38Å; E220-L222 PolarHBondContact O-N 3.24Å
221	G	50.9	Low	54.6	Low	66 Å²	66	88.5 Å²	88.5	68%	0.68	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.8	28.1	178.7	0	0	0	0	0	113.8	A217 E218	A217-G221 PolarHBondContact O-N 3.31Å; E218-G221 PolarHBondContact O-N 3.48Å
222	L	53.7	Low	52	Low	92 Å²	92	93.1 Å²	93.1	48%	0.482	54%	0.54	S	S	.	.			trans	-95	23.1	-177.4	-77.2	168.7	0	0	0	114	A217 E220	A217-L222 PolarHBondContact O-N 2.74Å; E220-L222 VanDerWaalsContact C-N 3.26Å; E220-L222 HydrophobicContact CB-CD1 4.13Å; E220-L222 HydrophobicContact CB-CG 4.38Å; E220-L222 PolarHBondContact O-N 3.24Å
223	S	36	Very low	49.3	Very low	81 Å²	81	101 Å²	101	57%	0.566	58%	0.576	S	S	*	*			trans	-90.9	118.4	175.2	-62.6	0	0	0	0	110.6
224	L	36.9	Very low	46.7	Very low	153 Å²	153	106.3 Å²	106.3	80%	0.801	61%	0.611	S	S	*	*			trans	81.3	84.9	166.3	-54.6	170.3	0	0	0	118.1
225	L	30.5	Very low	44.3	Very low	177 Å²	177	108 Å²	108	93%	0.927	63%	0.629	S	S	*	*			trans	-108.4	98.3	136.3	-78.7	173.5	0	0	0	108.5	V227	L225-V227 PolarHBondContact O-N 2.85Å
226	N	30.5	Very low	41.8	Very low	145 Å²	145	114.7 Å²	114.7	78%	0.775	65%	0.651	S	S	*	*			trans	-45.4	125.6	156.3	-97.8	-11.9	0	0	0	109.9
227	V	30.9	Very low	39.3	Very low	145 Å²	145	124.3 Å²	124.3	88%	0.879	70%	0.696	S	S	*	*			trans	-94.9	102.8	150.8	177	0	0	0	0	106	L225	L225-V227 PolarHBondContact O-N 2.85Å
228	G	27.3	Very low	36.9	Very low	64 Å²	64	133 Å²	133	66%	0.66	74%	0.736	S	S	*	*			trans	-69	146	176.4	0	0	0	0	0	112.3
229	I	27.6	Very low	34.6	Very low	179 Å²	179	133.4 Å²	133.4	92%	0.918	76%	0.756	S	S	*	*			trans	-70.4	143.4	170.1	-67.5	160	0	0	0	109.9
230	G	23.4	Very low	32.6	Very low	66 Å²	66	134.9 Å²	134.9	68%	0.68	77%	0.772	S	S	*	*			trans	-174.7	134.3	159.4	0	0	0	0	0	111.8
231	P	34.2	Very low	31.2	Very low	127 Å²	127	137.5 Å²	137.5	83%	0.825	79%	0.793	S	S	*	*			trans	-101.3	157	-142.8	37.9	-32.1	0	0	0	114.5
232	K	24.6	Very low	30.1	Very low	212 Å²	212	140.4 Å²	140.4	92%	0.922	80%	0.8	S	S	*	*			trans	-152.5	104.6	157.1	-112.8	-179.6	179	179.2	0	110.6
233	E	25.2	Very low	28.8	Very low	182 Å²	182	139.1 Å²	139.1	85%	0.85	81%	0.809	S	S	*	*			trans	-66.3	162.7	151.9	-83.5	-174.5	166.9	0	0	109.5
234	P	30.2	Very low	28.6	Very low	113 Å²	113	140.4 Å²	140.4	73%	0.734	82%	0.824	S	S	*	*			cis	-146.3	-155	38.6	41.2	-18.5	0	0	0	113.2
235	P	29.6	Very low	28.2	Very low	115 Å²	115	137.5 Å²	137.5	75%	0.747	82%	0.823	S	S	*	*			cis	-121.9	164.1	-40.5	18.7	3.3	0	0	0	113.7
236	R	27	Very low	28.1	Very low	244 Å²	244	134.3 Å²	134.3	92%	0.921	82%	0.815	S	S	*	*			trans	-3.3	131.3	157.6	-67.3	176.6	175.4	177.1	-3	119.3
237	E	27.1	Very low	28.2	Very low	202 Å²	202	132.5 Å²	132.5	94%	0.944	82%	0.82	S	S	*	*			trans	-151.5	138.3	131.8	-122.4	170.5	-167.6	0	0	110.9
238	E	24.6	Very low	28	Very low	192 Å²	192	134.1 Å²	134.1	90%	0.897	82%	0.818	S	S	*	*			trans	-70.8	140.8	-169.3	-68.5	171.5	146.9	0	0	112.7
239	A	26.2	Very low	28.5	Very low	111 Å²	111	139.4 Å²	139.4	92%	0.917	83%	0.831	S	S	*	*			trans	-82.7	115.1	168.6	0	0	0	0	0	110.3
240	A	24.7	Very low	28.6	Very low	88 Å²	88	135.3 Å²	135.3	73%	0.727	82%	0.823	S	S	*	*			trans	-139.9	110.1	159.8	0	0	0	0	0	110.2
241	V	33	Very low	28.9	Very low	133 Å²	133	137 Å²	137	81%	0.806	83%	0.825	S	S	*	*			trans	41.2	134.1	148.3	-146.8	0	0	0	0	120.2
242	P	29.9	Very low	28.9	Very low	128 Å²	128	140.6 Å²	140.6	83%	0.831	83%	0.83	S	S	*	*				-127.3	128.1	129	30.7	-17.6	0	0	0	109.7
243	G	25.2	Very low	29.2	Very low	64 Å²	64	134.2 Å²	134.2	66%	0.66	82%	0.817	S	S	*	*			cis	91.7	96.3	36.9	0	0	0	0	0	107.5
244	A	32.9	Very low	29.6	Very low	108 Å²	108	128.9 Å²	128.9	89%	0.893	81%	0.811	S	S	*	*			trans	-56	135.8	-177.4	0	0	0	0	0	112.8
245	A	26.8	Very low	29.7	Very low	92 Å²	92	129.8 Å²	129.8	76%	0.76	81%	0.814	S	S	*	*			trans	-143	96	158.7	0	0	0	0	0	107.3
246	S	28.2	Very low	30.3	Very low	111 Å²	111	133.1 Å²	133.1	78%	0.776	82%	0.82	S	S	*	*				56.5	99.2	111	-63.3	0	0	0	0	113.5	E248	S246-E248 PolarHBondContact O-N 2.78Å
247	A	33.4	Very low	31.5	Very low	106 Å²	106	129.7 Å²	129.7	88%	0.876	81%	0.814	S	S	*	*			trans	-65.2	96.2	158.6	0	0	0	0	0	108.4
248	E	27.3	Very low	33.3	Very low	179 Å²	179	125.4 Å²	125.4	84%	0.836	80%	0.804	S	S	*	*			trans	-82.2	115.4	161.1	-73.2	-156	150	0	0	109.1	S246 A250	S246-E248 PolarHBondContact O-N 2.78Å; E248-A250 VanDerWaalsContact C-N 3.27Å; E248-A250 PolarHBondContact O-N 3.32Å
249	L	38.2	Very low	36	Very low	176 Å²	176	121.1 Å²	121.1	92%	0.921	79%	0.793	S	S	*	*			trans	-56.3	93.3	155.6	-87.4	109.5	0	0	0	108.5	S251	L249-S251 PolarHBondContact O-N 2.94Å
250	A	29.2	Very low	39.1	Very low	92 Å²	92	118 Å²	118	76%	0.76	76%	0.761	S	S	*	*			trans	-78.5	103.8	161	0	0	0	0	0	108	E248 E252	E248-A250 VanDerWaalsContact C-N 3.27Å; E248-A250 PolarHBondContact O-N 3.32Å; A250-E252 PolarHBondContact O-N 3.15Å
251	S	29.8	Very low	42.4	Very low	102 Å²	102	117.1 Å²	117.1	71%	0.713	74%	0.742	S	S	*	*			trans	-38.3	126.3	165.5	52.1	0	0	0	0	112.3	L249 A253	L249-S251 PolarHBondContact O-N 2.94Å; S251-A253 PolarHBondContact O-N 3.34Å
252	E	33.8	Very low	45.3	Very low	202 Å²	202	110.9 Å²	110.9	94%	0.944	70%	0.703	S	S	*	*			trans	-65.1	76.7	160.9	-72.6	-169.2	156.2	0	0	109.4	A250 G254	A250-E252 PolarHBondContact O-N 3.15Å; E252-G254 PolarHBondContact O-N 3.47Å
253	A	30.2	Very low	48.4	Very low	78 Å²	78	111.2 Å²	111.2	65%	0.645	69%	0.688	S	S	*	*			trans	-78.7	97.5	155.4	0	0	0	0	0	105.6	S251 V255	S251-A253 PolarHBondContact O-N 3.34Å; A253-V255 PolarHBondContact O-N 3.1Å
254	G	33.9	Very low	51.7	Low	70 Å²	70	111.1 Å²	111.1	72%	0.722	68%	0.676	S	S	*	*			trans	-55.8	104.9	177.3	0	0	0	0	0	110.7	E252 Q256	E252-G254 PolarHBondContact O-N 3.47Å; G254-Q256 PolarHBondContact O-N 3.3Å
255	V	32.9	Very low	54.6	Low	133 Å²	133	109.2 Å²	109.2	81%	0.806	67%	0.667	S	S	*	*			trans	-68.4	92.7	163.1	-178.3	0	0	0	0	105.7	A253 Q257	A253-V255 PolarHBondContact O-N 3.1Å; V255-Q257 PolarHBondContact O-N 3.43Å
256	Q	41.3	Very low	57.8	Low	184 Å²	184	108.9 Å²	108.9	86%	0.86	65%	0.649	S	S	*	*			trans	-60.8	104.4	168.2	-74	-177.2	-4.3	0	0	106.7	G254	G254-Q256 PolarHBondContact O-N 3.3Å
257	Q	52.6	Low	61.1	Low	172 Å²	172	104.8 Å²	104.8	80%	0.804	62%	0.617	S	S	*	*	P	Polyproline II helix	trans	-54.7	133.7	164.9	-72.1	-171.3	-14.6	0	0	107.4	V255	V255-Q257 PolarHBondContact O-N 3.43Å
258	P	65.4	Low	64	Low	113 Å²	113	105.3 Å²	105.3	73%	0.734	60%	0.597	S	S	*	*	P	Polyproline II helix	trans	-56.3	144.3	179.1	22.5	-31.8	0	0	0	109.4	L260	P258-L260 PolarHBondContact O-N 3.3Å
259	P	81.9	Confident	67.4	Low	102 Å²	102	97.2 Å²	97.2	66%	0.662	56%	0.559	S	S	*	*	P	Polyproline II helix	trans	-55.9	127.1	179	-17.4	27	0	0	0	109.7	E261 S430	P259-E261 PolarHBondContact O-N 3.23Å; P259-S430 WeakPolarHBondContact CA-OG 3.39Å
260	L	89.8	Confident	70.2	Confident	46 Å²	46	89.1 Å²	89.1	24%	0.241	52%	0.517	C	S	.	.	P	Polyproline II helix	trans	-65.2	121.2	175.1	175.5	65.8	0	0	0	108.7	P258 L262 L326 R429 S430	P258-L260 PolarHBondContact O-N 3.3Å; L260-L262 HydrophobicContact CD1-CD2 4.02Å; L260-L262 HydrophobicContact CG-CD2 4.4Å; L260-L262 HydrophobicContact CG-CG 4.37Å; L260-L326 HydrophobicContact CD2-CD2 3.9Å; L260-L326 HydrophobicContact CD2-CG 3.96Å; L260-L326 HydrophobicContact CG-CD2 4.5Å; L260-R429 CarbonylContact O-C 3.53Å; L260-R429 WeakPolarHBondContact O-CA 3.49Å; L260-S430 PolarHBondContact N-OG 3.21Å; L260-S430 PolarHBondContact O-N 2.98Å
261	E	94.3	Very high	73.4	Confident	69 Å²	69	84.8 Å²	84.8	32%	0.322	48%	0.481	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	130.4	173.2	-177.4	173	113.2	0	0	109	P259 R263 T427 L428 R429	P259-E261 PolarHBondContact O-N 3.23Å; E261-R263 IonicContact OE1-NE 3.78Å; E261-R263 PolarHBondContact OE1-NE 2.87Å; E261-R263 IonicContact OE1-NH2 3.27Å; E261-T427 HydrophobicContact CG-CG2 3.57Å; E261-L428 CarbonylContact C-O 3.59Å; E261-L428 VanDerWaalsContact CA-O 3.31Å; E261-L428 WeakPolarHBondContact CA-O 3.49Å; E261-R429 HydrophobicContact CB-CG 4.46Å; E261-R429 HydrophobicContact CG-CG 4.14Å; E261-R429 IonicContact OE2-CZ 2.67Å; E261-R429 IonicContact OE2-NE 2.7Å; E261-R429 PolarHBondContact OE2-NE 2.88Å; E261-R429 IonicContact OE2-NH2 3.95Å; E261-R429 PolarHBondContact OE2-NH2 3.45Å
262	L	94.7	Very high	76.7	Confident	1 Å²	1	79.9 Å²	79.9	1%	0.005	45%	0.447	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	115	176.6	-57.3	175.3	0	0	0	108.9	L260 Y267 A312 E314 L326 T427 L428	L260-L262 HydrophobicContact CD1-CD2 4.02Å; L260-L262 HydrophobicContact CG-CD2 4.4Å; L260-L262 HydrophobicContact CG-CG 4.37Å; L262-Y267 HydrophobicContact CB-CD1 3.67Å; L262-Y267 HydrophobicContact CB-CE1 4.42Å; L262-Y267 HydrophobicContact CB-CG 4.18Å; L262-Y267 HydrophobicContact CD1-CG 4.47Å; L262-A312 HydrophobicContact CD1-CB 4.28Å; L262-E314 HydrophobicContact CD2-CB 3.98Å; L262-E314 HydrophobicContact CD2-CG 4.14Å; L262-L326 HydrophobicContact CD1-CD1 4.02Å; L262-L326 HydrophobicContact CD1-CG 4.14Å; L262-L326 HydrophobicContact CG-CD1 4.3Å; L262-T427 CarbonylContact O-C 3.55Å; L262-T427 WeakPolarHBondContact O-CA 3.16Å; L262-L428 HydrophobicContact CB-CB 4.31Å; L262-L428 PolarHBondContact N-O 3.03Å; L262-L428 PolarHBondContact O-N 3.03Å
263	R	94.7	Very high	79.7	Confident	135 Å²	135	70.3 Å²	70.3	51%	0.509	40%	0.402	S	S	.	.			trans	-87.1	164.2	-178.6	-59.5	175.6	171.3	177.2	-1.1	112	E261 G265 E266 Y267 T427	E261-R263 IonicContact OE1-NE 3.78Å; E261-R263 PolarHBondContact OE1-NE 2.87Å; E261-R263 IonicContact OE1-NH2 3.27Å; R263-G265 PolarHBondContact O-N 3.48Å; R263-E266 HydrophobicContact CB-CG 4.2Å; R263-E266 VanDerWaalsContact CB-OE2 3.26Å; R263-E266 WeakPolarHBondContact CB-OE2 2.95Å; R263-E266 WeakPolarHBondContact CG-OE2 3.23Å; R263-E266 PolarHBondContact N-OE2 3.47Å; R263-E266 WeakPolarHBondContact O-CB 3.3Å; R263-E266 PolarHBondContact O-N 3.25Å; R263-Y267 WeakPolarHBondContact O-CD1 3.41Å; R263-Y267 WeakPolarHBondContact O-CE1 3.31Å; R263-T427 HydrophobicContact CG-CG2 4.28Å
264	P	95.1	Very high	82.8	Confident	62 Å²	62	67.6 Å²	67.6	40%	0.403	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.6	125	175.9	-24.9	33.7	0	0	0	111.7	E266 G425 H426	P264-E266 VanDerWaalsContact C-N 3.35Å; P264-G425 VanDerWaalsContact CG-C 3.41Å; P264-G425 WeakPolarHBondContact CG-O 3.14Å; P264-H426 WeakPolarHBondContact CG-O 3.21Å
265	G	92.4	Very high	85.4	Confident	68 Å²	68	66.5 Å²	66.5	70%	0.701	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	91.6	-17.5	-177.8	0	0	0	0	0	115	R263 Y267 T315	R263-G265 PolarHBondContact O-N 3.48Å; G265-Y267 VanDerWaalsContact C-N 3.31Å; G265-T315 PolarHBondContact O-OG1 3.09Å
266	E	94.9	Very high	87.8	Confident	85 Å²	85	61.5 Å²	61.5	40%	0.397	33%	0.33	S	S	.	.	S	Bend	trans	-86.8	-1.5	176.8	-62.3	176.1	173.9	0	0	112.9	R263 P264 E314 T315	R263-E266 HydrophobicContact CB-CG 4.2Å; R263-E266 VanDerWaalsContact CB-OE2 3.26Å; R263-E266 WeakPolarHBondContact CB-OE2 2.95Å; R263-E266 WeakPolarHBondContact CG-OE2 3.23Å; R263-E266 PolarHBondContact N-OE2 3.47Å; R263-E266 WeakPolarHBondContact O-CB 3.3Å; R263-E266 PolarHBondContact O-N 3.25Å; P264-E266 VanDerWaalsContact C-N 3.35Å; E266-E314 CarbonylContact O-C 3.59Å; E266-E314 WeakPolarHBondContact O-CA 3.5Å; E266-T315 VanDerWaalsContact C-OG1 3.28Å; E266-T315 PolarHBondContact O-N 3.18Å; E266-T315 PolarHBondContact O-OG1 3.49Å; E266-T315 VanDerWaalsContact O-OG1 3.13Å
267	Y	96.6	Very high	89.8	Confident	25 Å²	25	53.5 Å²	53.5	10%	0.098	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	161	178	68.2	-88.9	0	0	0	112.6	L262 R263 G265 V269 A312 Q313 Y423 H426 L428	L262-Y267 HydrophobicContact CB-CD1 3.67Å; L262-Y267 HydrophobicContact CB-CE1 4.42Å; L262-Y267 HydrophobicContact CB-CG 4.18Å; L262-Y267 HydrophobicContact CD1-CG 4.47Å; R263-Y267 WeakPolarHBondContact O-CD1 3.41Å; R263-Y267 WeakPolarHBondContact O-CE1 3.31Å; G265-Y267 VanDerWaalsContact C-N 3.31Å; Y267-V269 HydrophobicContact CD2-CG2 4.22Å; Y267-V269 HydrophobicContact CE2-CG2 3.98Å; Y267-A312 HydrophobicContact CD2-CB 3.79Å; Y267-A312 HydrophobicContact CE2-CB 4.34Å; Y267-A312 HydrophobicContact CG-CB 4.34Å; Y267-Q313 CarbonylContact C-O 3.54Å; Y267-Q313 WeakPolarHBondContact CA-O 3.42Å; Y267-Q313 WeakPolarHBondContact CB-O 3.39Å; Y267-Y423 PolarHBondContact OH-O 2.87Å; Y267-H426 WeakPolarHBondContact CE1-O 3.37Å; Y267-H426 PolarHBondContact OH-O 3.38Å; Y267-L428 HydrophobicContact CD1-CD1 4.46Å; Y267-L428 HydrophobicContact CD2-CD1 4.06Å; Y267-L428 HydrophobicContact CE1-CD1 4.08Å; Y267-L428 HydrophobicContact CE1-CG 4.15Å; Y267-L428 HydrophobicContact CE2-CD1 3.69Å; Y267-L428 HydrophobicContact CE2-CG 4.47Å; Y267-L428 HydrophobicContact CG-CD1 4.43Å
268	R	96.1	Very high	90.7	Very high	118 Å²	118	46.6 Å²	46.6	45%	0.445	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	141.2	168.9	58.6	176.7	177	-92.5	-1.5	110.2	L270 A312 Q313 T315	R268-L270 HydrophobicContact CG-CD2 4.09Å; R268-A312 WeakPolarHBondContact O-CA 3.46Å; R268-Q313 PolarHBondContact N-O 3.41Å; R268-Q313 PolarHBondContact O-N 3.2Å; R268-T315 HydrophobicContact CB-CG2 4.37Å; R268-T315 HydrophobicContact CG-CG2 4.36Å
269	V	97.1	Very high	90.3	Very high	9 Å²	9	50.4 Å²	50.4	6%	0.055	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	121.4	173	179.8	0	0	0	0	109	Y267 W310 V311 L328 L419 Q420	Y267-V269 HydrophobicContact CD2-CG2 4.22Å; Y267-V269 HydrophobicContact CE2-CG2 3.98Å; V269-W310 HydrophobicContact CG1-CB 4.22Å; V269-V311 WeakPolarHBondContact CA-O 3.35Å; V269-L328 HydrophobicContact CG1-CD2 3.77Å; V269-L328 HydrophobicContact CG2-CD2 4.46Å; V269-L419 HydrophobicContact CG1-CB 4.4Å; V269-Q420 HydrophobicContact CB-CG 3.98Å; V269-Q420 HydrophobicContact CG1-CG 4.45Å; V269-Q420 PolarHBondContact O-NE2 2.9Å
270	L	96.7	Very high	88.9	Confident	6 Å²	6	47.6 Å²	47.6	3%	0.031	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	154.3	178.3	61.8	140.6	0	0	0	112.2	R268 T299 W310 V311 Q313	R268-L270 HydrophobicContact CG-CD2 4.09Å; L270-T299 HydrophobicContact CD1-CG2 3.32Å; L270-W310 WeakPolarHBondContact O-CA 3.48Å; L270-V311 HydrophobicContact CD1-CG2 4.07Å; L270-V311 HydrophobicContact CD2-CG2 3.9Å; L270-V311 HydrophobicContact CG-CG2 3.68Å; L270-V311 PolarHBondContact N-O 3.26Å; L270-V311 PolarHBondContact O-N 3.11Å; L270-Q313 HydrophobicContact CD2-CB 3.52Å; L270-Q313 HydrophobicContact CD2-CG 4.48Å
271	L	98.3	Very high	86.8	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	130.2	175.3	176.7	66.8	0	0	0	110	V273 L291 V296 T297 H298 T299 F308 W310 L412	L271-V273 HydrophobicContact CD2-CG2 4.05Å; L271-V273 HydrophobicContact CG-CG2 4.05Å; L271-L291 HydrophobicContact CD2-CD1 3.91Å; L271-L291 HydrophobicContact CD2-CD2 4.03Å; L271-V296 HydrophobicContact CB-CG1 4.21Å; L271-V296 HydrophobicContact CD2-CG1 4.08Å; L271-T297 PolarHBondContact N-O 3.13Å; L271-T297 VanDerWaalsContact N-O 3.15Å; L271-H298 HydrophobicContact CB-CB 3.96Å; L271-H298 HydrophobicContact CD2-CB 4.37Å; L271-H298 HydrophobicContact CG-CB 4.36Å; L271-H298 CarbonylContact O-C 3.16Å; L271-H298 WeakPolarHBondContact O-CA 3.23Å; L271-H298 WeakPolarHBondContact O-CB 3.31Å; L271-T299 PolarHBondContact O-N 2.94Å; L271-F308 HydrophobicContact CD1-CB 4Å; L271-F308 HydrophobicContact CD1-CD1 4.26Å; L271-W310 HydrophobicContact CD1-CD2 4.35Å; L271-W310 HydrophobicContact CD1-CH2 4.45Å; L271-W310 HydrophobicContact CD1-CZ2 3.75Å; L271-L412 HydrophobicContact CD2-CB 4.33Å
272	C	97.5	Very high	85.1	Confident	0 Å²	0	49 Å²	49	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	121	170.2	-175	0	0	0	0	109.4	T299 F308 V309	C272-T299 WeakPolarHBondContact CA-O 3.32Å; C272-F308 WeakPolarHBondContact O-CA 3.48Å; C272-V309 HydrophobicContact CB-CG2 3.72Å; C272-V309 PolarHBondContact N-O 2.72Å; C272-V309 PolarHBondContact O-N 2.72Å; C272-V309 VanDerWaalsContact O-N 3.08Å
273	V	96.8	Very high	83.3	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	131.4	-178	-178.5	0	0	0	0	109.3	L271 E277 T278 L288 L291 H298 T299 V300 R301 F308	L271-V273 HydrophobicContact CD2-CG2 4.05Å; L271-V273 HydrophobicContact CG-CG2 4.05Å; V273-E277 HydrophobicContact CG1-CB 4.08Å; V273-T278 HydrophobicContact CG1-CG2 4.04Å; V273-L288 HydrophobicContact CG1-CD2 4.37Å; V273-L291 HydrophobicContact CG2-CD1 4.14Å; V273-H298 HydrophobicContact CG2-CB 4.45Å; V273-T299 PolarHBondContact N-O 3.33Å; V273-V300 HydrophobicContact CB-CG2 4.49Å; V273-V300 WeakPolarHBondContact O-CA 3.48Å; V273-R301 PolarHBondContact O-N 3.19Å; V273-F308 HydrophobicContact CB-CD1 4.28Å; V273-F308 HydrophobicContact CB-CE1 4.27Å; V273-F308 HydrophobicContact CG1-CD1 4.15Å; V273-F308 HydrophobicContact CG1-CE1 3.68Å; V273-F308 HydrophobicContact CG2-CD1 3.98Å; V273-F308 HydrophobicContact CG2-CE1 4.06Å
274	D	95.3	Very high	81.9	Confident	22 Å²	22	51 Å²	51	12%	0.118	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.4	142.7	174.7	-176.4	52.3	0	0	0	112.1	G276 E277 R301 L303 D307	D274-G276 PolarHBondContact O-N 2.82Å; D274-G276 VanDerWaalsContact OD2-CA 3.23Å; D274-G276 WeakPolarHBondContact OD2-CA 3.45Å; D274-G276 PolarHBondContact OD2-N 2.76Å; D274-E277 WeakPolarHBondContact O-CB 3.45Å; D274-E277 PolarHBondContact O-N 3.32Å; D274-E277 VanDerWaalsContact O-N 3.1Å; D274-R301 CarbonylContact C-O 3.55Å; D274-R301 VanDerWaalsContact CA-O 3.25Å; D274-R301 WeakPolarHBondContact CA-O 3.27Å; D274-L303 HydrophobicContact CB-CB 4.07Å; D274-L303 HydrophobicContact CB-CD1 4.09Å; D274-L303 HydrophobicContact CB-CG 4.06Å; D274-L303 PolarHBondContact OD1-N 3.31Å; D274-D307 PolarHBondContact N-O 3.26Å
275	I	89.5	Confident	80.8	Confident	46 Å²	46	50.9 Å²	50.9	24%	0.236	31%	0.306	C	S	.	.	G	3₁₀ helix	trans	-59.6	-32	176.3	-71.5	165.9	0	0	0	111.5	E277 T278 R279 V300 R301 K302	I275-E277 PolarHBondContact O-N 2.74Å; I275-T278 CarbonylContact O-C 3.42Å; I275-T278 WeakPolarHBondContact O-CA 3.07Å; I275-T278 PolarHBondContact O-N 3.32Å; I275-T278 PolarHBondContact O-OG1 2.71Å; I275-R279 HydrophobicContact CG2-CB 4.28Å; I275-R279 VanDerWaalsContact CG2-CD 3.43Å; I275-R279 HydrophobicContact CG2-CG 3.75Å; I275-R279 PolarHBondContact O-N 3.12Å; I275-V300 HydrophobicContact CG1-CG1 3.84Å; I275-R301 WeakPolarHBondContact CG1-O 3.39Å; I275-R301 PolarHBondContact N-O 3.3Å; I275-K302 HydrophobicContact CD1-CB 3.91Å
276	G	83.9	Confident	80.4	Confident	29 Å²	29	50.5 Å²	50.5	30%	0.299	29%	0.286	S	S	.	.	G	3₁₀ helix	trans	-60.6	-30.1	176.8	0	0	0	0	0	113.9	D274 T278 R284	D274-G276 PolarHBondContact O-N 2.82Å; D274-G276 VanDerWaalsContact OD2-CA 3.23Å; D274-G276 WeakPolarHBondContact OD2-CA 3.45Å; D274-G276 PolarHBondContact OD2-N 2.76Å; G276-T278 PolarHBondContact O-N 3.16Å; G276-R284 PolarHBondContact O-NH1 2.8Å; G276-R284 VanDerWaalsContact O-NH1 3.1Å
277	E	81.5	Confident	80.1	Confident	16 Å²	16	46.6 Å²	46.6	8%	0.075	27%	0.268	C	S	.	.	G	3₁₀ helix	trans	-76	-12.2	173.7	-71	-63	93.4	0	0	112.8	V273 D274 I275 R284 D307 F308 R334	V273-E277 HydrophobicContact CG1-CB 4.08Å; D274-E277 WeakPolarHBondContact O-CB 3.45Å; D274-E277 PolarHBondContact O-N 3.32Å; D274-E277 VanDerWaalsContact O-N 3.1Å; I275-E277 PolarHBondContact O-N 2.74Å; E277-R284 VanDerWaalsContact O-CB 3.31Å; E277-R284 WeakPolarHBondContact O-CB 3.16Å; E277-D307 HydrophobicContact CG-CB 3.92Å; E277-F308 HydrophobicContact CB-CZ 4.44Å; E277-F308 HydrophobicContact CG-CE2 4.4Å; E277-F308 HydrophobicContact CG-CZ 3.95Å; E277-R334 IonicContact OE1-NH1 2.67Å; E277-R334 WeakPolarHBondContact OE2-CD 3.38Å; E277-R334 IonicContact OE2-CZ 3.47Å; E277-R334 IonicContact OE2-NE 2.86Å; E277-R334 IonicContact OE2-NH1 3.12Å; E277-R334 PolarHBondContact OE2-NH1 2.97Å
278	T	72.8	Confident	79.9	Confident	27 Å²	27	47 Å²	47	17%	0.166	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.8	-28.6	-178	70.3	0	0	0	0	113.4	V273 I275 G276 L288 V300	V273-T278 HydrophobicContact CG1-CG2 4.04Å; I275-T278 CarbonylContact O-C 3.42Å; I275-T278 WeakPolarHBondContact O-CA 3.07Å; I275-T278 PolarHBondContact O-N 3.32Å; I275-T278 PolarHBondContact O-OG1 2.71Å; G276-T278 PolarHBondContact O-N 3.16Å; T278-L288 HydrophobicContact CG2-CD1 3.63Å; T278-L288 HydrophobicContact CG2-CD2 3.93Å; T278-L288 HydrophobicContact CG2-CG 3.92Å; T278-V300 HydrophobicContact CG2-CG1 3.66Å; T278-V300 HydrophobicContact CG2-CG2 4.09Å
279	R	55.9	Low	79.6	Confident	193 Å²	193	49.8 Å²	49.8	73%	0.728	28%	0.282	S	S	*	.	S	Bend	trans	-104.7	101.1	-177.1	-68.3	-170.6	175	169	-6.5	110.9	I275	I275-R279 HydrophobicContact CG2-CB 4.28Å; I275-R279 VanDerWaalsContact CG2-CD 3.43Å; I275-R279 HydrophobicContact CG2-CG 3.75Å; I275-R279 PolarHBondContact O-N 3.12Å
280	G	53.9	Low	79.5	Confident	42 Å²	42	50.4 Å²	50.4	43%	0.433	29%	0.285	S	S	.	.	S	Bend	trans	179.4	160.3	173.8	0	0	0	0	0	111.6
281	G	44.3	Very low	79.4	Confident	87 Å²	87	50.1 Å²	50.1	90%	0.897	28%	0.283	S	S	*	.	S	Bend	trans	-73.3	141	171.6	0	0	0	0	0	111.4
282	G	60.3	Low	79.2	Confident	59 Å²	59	55.8 Å²	55.8	61%	0.608	31%	0.309	S	S	*	.	S	Bend	trans	97.7	-154.1	179	0	0	0	0	0	114.4	R284 P285	G282-R284 PolarHBondContact O-N 2.82Å; G282-P285 WeakPolarHBondContact O-CD 3.47Å
283	H	55.6	Low	79.1	Confident	99 Å²	99	62.8 Å²	62.8	46%	0.458	34%	0.336	S	S	.	.	S	Bend	trans	-55	3.9	-171.1	-62.4	-77.2	0	0	0	118.3	E286 H371 I405	H283-E286 IonicContact CG-OE2 3.73Å; H283-E286 IonicContact ND1-OE2 2.87Å; H283-E286 PolarHBondContact ND1-OE2 2.86Å; H283-E286 WeakPolarHBondContact O-CB 3.39Å; H283-E286 PolarHBondContact O-N 2.67Å; H283-H371 AromaticContact CD2-CE1 3.87Å; H283-H371 AromaticContact CD2-NE2 3.57Å; H283-H371 AromaticContact NE2-CE1 3.78Å; H283-H371 AromaticContact NE2-NE2 3.38Å; H283-H371 PolarHBondContact NE2-NE2 3.24Å; H283-I405 HydrophobicContact CB-CD1 4.42Å; H283-I405 WeakPolarHBondContact O-CD1 3.4Å
284	R	64.8	Low	79.1	Confident	77 Å²	77	64.3 Å²	64.3	29%	0.291	34%	0.344	S	S	.	.	H	α-helix	trans	-75.5	-34.5	-175.3	-73.7	-168.7	-172.9	165.3	4.4	117.1	G276 E277 G282 E286	G276-R284 PolarHBondContact O-NH1 2.8Å; G276-R284 VanDerWaalsContact O-NH1 3.1Å; E277-R284 VanDerWaalsContact O-CB 3.31Å; E277-R284 WeakPolarHBondContact O-CB 3.16Å; G282-R284 PolarHBondContact O-N 2.82Å; R284-E286 PolarHBondContact O-N 2.92Å
285	P	72.5	Confident	79.1	Confident	61 Å²	61	71 Å²	71	40%	0.396	37%	0.374	S	S	.	.	H	α-helix	trans	-71.8	-10.6	169.4	26.9	-24.1	0	0	0	112.4	G282 R289	G282-P285 WeakPolarHBondContact O-CD 3.47Å; P285-R289 WeakPolarHBondContact O-CG 3.44Å; P285-R289 PolarHBondContact O-N 2.83Å
286	E	84.4	Confident	79.5	Confident	60 Å²	60	69.3 Å²	69.3	28%	0.28	37%	0.366	S	S	.	.	H	α-helix	trans	-70	-37.5	176.5	-168.6	174	-173.1	0	0	111.4	H283 R284 L288 R289 E290 I405	H283-E286 IonicContact CG-OE2 3.73Å; H283-E286 IonicContact ND1-OE2 2.87Å; H283-E286 PolarHBondContact ND1-OE2 2.86Å; H283-E286 WeakPolarHBondContact O-CB 3.39Å; H283-E286 PolarHBondContact O-N 2.67Å; R284-E286 PolarHBondContact O-N 2.92Å; E286-L288 PolarHBondContact O-N 3.12Å; E286-R289 PolarHBondContact O-N 3Å; E286-E290 WeakPolarHBondContact O-CG 3.36Å; E286-E290 PolarHBondContact O-N 2.77Å; E286-I405 HydrophobicContact CB-CD1 4.21Å; E286-I405 HydrophobicContact CG-CG2 4.01Å
287	L	89.3	Confident	80	Confident	2 Å²	2	71.6 Å²	71.6	1%	0.01	37%	0.374	C	S	.	.	H	α-helix	trans	-58.8	-47.6	176.1	-178.6	62.9	0	0	0	112	R289 E290 L291 F308 I405 A409 L412	L287-R289 VanDerWaalsContact C-N 3.33Å; L287-R289 PolarHBondContact O-N 3.38Å; L287-E290 PolarHBondContact O-N 3.5Å; L287-L291 HydrophobicContact CD1-CD1 4.44Å; L287-L291 HydrophobicContact CD1-CG 4.4Å; L287-L291 HydrophobicContact CG-CD1 4.13Å; L287-L291 HydrophobicContact CG-CG 4.49Å; L287-L291 VanDerWaalsContact O-CG 3.31Å; L287-L291 WeakPolarHBondContact O-CG 3.42Å; L287-L291 PolarHBondContact O-N 3.09Å; L287-F308 HydrophobicContact CD2-CE1 3.7Å; L287-F308 HydrophobicContact CD2-CZ 3.5Å; L287-I405 HydrophobicContact CB-CD1 3.86Å; L287-I405 HydrophobicContact CB-CG1 4.09Å; L287-I405 HydrophobicContact CD1-CG1 4.2Å; L287-A409 HydrophobicContact CD1-CB 3.85Å; L287-L412 HydrophobicContact CD1-CD1 4.44Å
288	L	90.7	Very high	80.6	Confident	34 Å²	34	73 Å²	73	18%	0.178	38%	0.381	C	S	.	.	H	α-helix	trans	-63.4	-40.5	179.1	-67.2	-176.1	0	0	0	111.8	V273 T278 E286 E290 L291 Q292 V300	V273-L288 HydrophobicContact CG1-CD2 4.37Å; T278-L288 HydrophobicContact CG2-CD1 3.63Å; T278-L288 HydrophobicContact CG2-CD2 3.93Å; T278-L288 HydrophobicContact CG2-CG 3.92Å; E286-L288 PolarHBondContact O-N 3.12Å; L288-E290 VanDerWaalsContact C-N 3.35Å; L288-L291 PolarHBondContact O-N 3.03Å; L288-Q292 WeakPolarHBondContact O-CB 3.38Å; L288-Q292 VanDerWaalsContact O-CG 3.25Å; L288-Q292 WeakPolarHBondContact O-CG 3.48Å; L288-Q292 PolarHBondContact O-N 2.87Å; L288-V300 HydrophobicContact CD1-CG2 4.27Å; L288-V300 HydrophobicContact CD2-CG2 3.96Å
289	R	91.4	Very high	81.7	Confident	177 Å²	177	73.5 Å²	73.5	67%	0.668	38%	0.384	S	S	*	.	H	α-helix	trans	-62.5	-42.5	176.3	-73.1	175.6	179.5	177.6	-0.8	111.6	P285 E286 L287 Q292 R293	P285-R289 WeakPolarHBondContact O-CG 3.44Å; P285-R289 PolarHBondContact O-N 2.83Å; E286-R289 PolarHBondContact O-N 3Å; L287-R289 VanDerWaalsContact C-N 3.33Å; L287-R289 PolarHBondContact O-N 3.38Å; R289-Q292 PolarHBondContact O-N 3.47Å; R289-R293 WeakPolarHBondContact O-CB 3.43Å; R289-R293 PolarHBondContact O-N 3.41Å
290	E	94.1	Very high	83.5	Confident	22 Å²	22	67.2 Å²	67.2	10%	0.103	37%	0.367	C	S	.	.	H	α-helix	trans	-67.1	-40.9	176.5	-71.5	-63.1	155.3	0	0	112	E286 L287 L288 Q292 R293 L294 K406 A409	E286-E290 WeakPolarHBondContact O-CG 3.36Å; E286-E290 PolarHBondContact O-N 2.77Å; L287-E290 PolarHBondContact O-N 3.5Å; L288-E290 VanDerWaalsContact C-N 3.35Å; E290-Q292 VanDerWaalsContact C-N 3.32Å; E290-Q292 PolarHBondContact O-N 2.89Å; E290-R293 PolarHBondContact O-N 3.35Å; E290-R293 IonicContact OE1-NE 3.64Å; E290-R293 IonicContact OE2-CZ 2.82Å; E290-R293 VanDerWaalsContact OE2-CZ 3.27Å; E290-R293 IonicContact OE2-NE 3.33Å; E290-R293 PolarHBondContact OE2-NE 2.83Å; E290-R293 IonicContact OE2-NH2 3.81Å; E290-R293 PolarHBondContact OE2-NH2 3.41Å; E290-L294 WeakPolarHBondContact O-CB 3.35Å; E290-L294 VanDerWaalsContact O-CG 3.25Å; E290-L294 WeakPolarHBondContact O-CG 3.37Å; E290-L294 PolarHBondContact O-N 3.46Å; E290-K406 HydrophobicContact CG-CG 4.05Å; E290-K406 WeakPolarHBondContact OE1-CE 3.39Å; E290-A409 HydrophobicContact CB-CB 3.55Å
291	L	94.8	Very high	85.4	Confident	0 Å²	0	67.7 Å²	67.7	0%	0	36%	0.355	C	S	.	.	H	α-helix	trans	-61.6	-40.1	173.7	-70.8	173.7	0	0	0	112.1	L271 V273 L287 L288 L294 H295 V296 A409 L412	L271-L291 HydrophobicContact CD2-CD1 3.91Å; L271-L291 HydrophobicContact CD2-CD2 4.03Å; V273-L291 HydrophobicContact CG2-CD1 4.14Å; L287-L291 HydrophobicContact CD1-CD1 4.44Å; L287-L291 HydrophobicContact CD1-CG 4.4Å; L287-L291 HydrophobicContact CG-CD1 4.13Å; L287-L291 HydrophobicContact CG-CG 4.49Å; L287-L291 VanDerWaalsContact O-CG 3.31Å; L287-L291 WeakPolarHBondContact O-CG 3.42Å; L287-L291 PolarHBondContact O-N 3.09Å; L288-L291 PolarHBondContact O-N 3.03Å; L291-L294 CarbonylContact O-C 3.38Å; L291-L294 PolarHBondContact O-N 3.37Å; L291-H295 PolarHBondContact O-N 2.86Å; L291-V296 HydrophobicContact CB-CB 4.37Å; L291-V296 HydrophobicContact CD2-CB 4.27Å; L291-V296 HydrophobicContact CD2-CG1 4.41Å; L291-V296 HydrophobicContact CD2-CG2 4.09Å; L291-V296 WeakPolarHBondContact O-CB 3.33Å; L291-V296 PolarHBondContact O-N 2.84Å; L291-A409 HydrophobicContact CD2-CB 4.34Å; L291-L412 HydrophobicContact CD2-CB 4.17Å
292	Q	94.1	Very high	87.8	Confident	118 Å²	118	69.7 Å²	69.7	55%	0.551	34%	0.339	S	S	*	.	H	α-helix	trans	-64.1	-46.4	173.7	-73.8	172.6	-11	0	0	111.5	L288 R289 E290 L294 H295	L288-Q292 WeakPolarHBondContact O-CB 3.38Å; L288-Q292 VanDerWaalsContact O-CG 3.25Å; L288-Q292 WeakPolarHBondContact O-CG 3.48Å; L288-Q292 PolarHBondContact O-N 2.87Å; R289-Q292 PolarHBondContact O-N 3.47Å; E290-Q292 VanDerWaalsContact C-N 3.32Å; E290-Q292 PolarHBondContact O-N 2.89Å; Q292-L294 PolarHBondContact O-N 2.86Å; Q292-H295 WeakPolarHBondContact O-CA 3.41Å; Q292-H295 PolarHBondContact O-N 3.31Å
293	R	96.1	Very high	89.4	Confident	147 Å²	147	67.4 Å²	67.4	56%	0.555	31%	0.313	S	S	*	.	H	α-helix	trans	-59.1	-34.6	176.2	-170	-173.2	66.8	78.2	1.2	112.1	R289 E290 H295	R289-R293 WeakPolarHBondContact O-CB 3.43Å; R289-R293 PolarHBondContact O-N 3.41Å; E290-R293 PolarHBondContact O-N 3.35Å; E290-R293 IonicContact OE1-NE 3.64Å; E290-R293 IonicContact OE2-CZ 2.82Å; E290-R293 VanDerWaalsContact OE2-CZ 3.27Å; E290-R293 IonicContact OE2-NE 3.33Å; E290-R293 PolarHBondContact OE2-NE 2.83Å; E290-R293 IonicContact OE2-NH2 3.81Å; E290-R293 PolarHBondContact OE2-NH2 3.41Å; R293-H295 PolarHBondContact O-CE1 2.95Å; R293-H295 PolarHBondContact O-N 2.91Å; R293-H295 PolarHBondContact O-ND1 3.4Å
294	L	96.5	Very high	91.2	Very high	32 Å²	32	65.4 Å²	65.4	17%	0.168	30%	0.304	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.3	5.4	176.5	-66.5	171.6	0	0	0	113.6	E290 L291 Q292 V296 A409 A410 A413 R417	E290-L294 WeakPolarHBondContact O-CB 3.35Å; E290-L294 VanDerWaalsContact O-CG 3.25Å; E290-L294 WeakPolarHBondContact O-CG 3.37Å; E290-L294 PolarHBondContact O-N 3.46Å; L291-L294 CarbonylContact O-C 3.38Å; L291-L294 PolarHBondContact O-N 3.37Å; Q292-L294 PolarHBondContact O-N 2.86Å; L294-V296 VanDerWaalsContact C-N 3.28Å; L294-V296 HydrophobicContact CB-CG2 4.02Å; L294-V296 PolarHBondContact O-N 3.22Å; L294-A409 HydrophobicContact CD1-CB 4.16Å; L294-A410 HydrophobicContact CD1-CB 4.33Å; L294-A413 HydrophobicContact CB-CB 4.05Å; L294-A413 HydrophobicContact CD1-CB 3.87Å; L294-R417 PolarHBondContact O-NH2 3.46Å
295	H	95.7	Very high	92.6	Very high	162 Å²	162	62 Å²	62	75%	0.75	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.6	40	179.1	-55.8	78	0	0	0	112.7	L291 Q292 R293	L291-H295 PolarHBondContact O-N 2.86Å; Q292-H295 WeakPolarHBondContact O-CA 3.41Å; Q292-H295 PolarHBondContact O-N 3.31Å; R293-H295 PolarHBondContact O-CE1 2.95Å; R293-H295 PolarHBondContact O-N 2.91Å; R293-H295 PolarHBondContact O-ND1 3.4Å
296	V	96	Very high	93.7	Very high	11 Å²	11	59.4 Å²	59.4	7%	0.067	28%	0.276	C	S	.	.			trans	-87.2	117.9	177.5	-175.9	0	0	0	0	109.7	L271 L291 L294 H298 A413 T416	L271-V296 HydrophobicContact CB-CG1 4.21Å; L271-V296 HydrophobicContact CD2-CG1 4.08Å; L291-V296 HydrophobicContact CB-CB 4.37Å; L291-V296 HydrophobicContact CD2-CB 4.27Å; L291-V296 HydrophobicContact CD2-CG1 4.41Å; L291-V296 HydrophobicContact CD2-CG2 4.09Å; L291-V296 WeakPolarHBondContact O-CB 3.33Å; L291-V296 PolarHBondContact O-N 2.84Å; L294-V296 VanDerWaalsContact C-N 3.28Å; L294-V296 HydrophobicContact CB-CG2 4.02Å; L294-V296 PolarHBondContact O-N 3.22Å; V296-H298 PolarHBondContact O-N 3.26Å; V296-H298 PolarHBondContact O-ND1 2.91Å; V296-A413 HydrophobicContact CG2-CB 3.35Å; V296-T416 HydrophobicContact CG1-CG2 4.15Å
297	T	94.4	Very high	94.2	Very high	77 Å²	77	57.7 Å²	57.7	47%	0.472	27%	0.268	S	S	.	.			trans	-66.6	116.5	168.9	51.6	0	0	0	0	109.6	L271	L271-T297 PolarHBondContact N-O 3.13Å; L271-T297 VanDerWaalsContact N-O 3.15Å
298	H	95.8	Very high	94.7	Very high	47 Å²	47	57.6 Å²	57.6	22%	0.218	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	159.3	-176.5	66.8	-81.2	0	0	0	112.6	L271 V273 V296	L271-H298 HydrophobicContact CB-CB 3.96Å; L271-H298 HydrophobicContact CD2-CB 4.37Å; L271-H298 HydrophobicContact CG-CB 4.36Å; L271-H298 CarbonylContact O-C 3.16Å; L271-H298 WeakPolarHBondContact O-CA 3.23Å; L271-H298 WeakPolarHBondContact O-CB 3.31Å; V273-H298 HydrophobicContact CG2-CB 4.45Å; V296-H298 PolarHBondContact O-N 3.26Å; V296-H298 PolarHBondContact O-ND1 2.91Å
299	T	95.1	Very high	95	Very high	37 Å²	37	56 Å²	56	23%	0.227	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	148	169.6	54.6	0	0	0	0	110.1	L270 L271 C272 V273 R301	L270-T299 HydrophobicContact CD1-CG2 3.32Å; L271-T299 PolarHBondContact O-N 2.94Å; C272-T299 WeakPolarHBondContact CA-O 3.32Å; V273-T299 PolarHBondContact N-O 3.33Å; T299-R301 PolarHBondContact OG1-NE 3Å
300	V	94.7	Very high	95.4	Very high	61 Å²	61	47.5 Å²	47.5	37%	0.37	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	119.1	174.7	-178.3	0	0	0	0	108.9	V273 I275 T278 L288	V273-V300 HydrophobicContact CB-CG2 4.49Å; V273-V300 WeakPolarHBondContact O-CA 3.48Å; I275-V300 HydrophobicContact CG1-CG1 3.84Å; T278-V300 HydrophobicContact CG2-CG1 3.66Å; T278-V300 HydrophobicContact CG2-CG2 4.09Å; L288-V300 HydrophobicContact CD1-CG2 4.27Å; L288-V300 HydrophobicContact CD2-CG2 3.96Å
301	R	93.6	Very high	95.5	Very high	51 Å²	51	46.5 Å²	46.5	19%	0.192	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	163	-176.2	-55.9	-175.7	-173.8	-166.5	-4	111	V273 D274 I275 T299 L303 E325 F456	V273-R301 PolarHBondContact O-N 3.19Å; D274-R301 CarbonylContact C-O 3.55Å; D274-R301 VanDerWaalsContact CA-O 3.25Å; D274-R301 WeakPolarHBondContact CA-O 3.27Å; I275-R301 WeakPolarHBondContact CG1-O 3.39Å; I275-R301 PolarHBondContact N-O 3.3Å; T299-R301 PolarHBondContact OG1-NE 3Å; R301-L303 PolarHBondContact O-N 2.86Å; R301-E325 IonicContact CZ-OE1 3.64Å; R301-E325 IonicContact CZ-OE2 3.72Å; R301-E325 VanDerWaalsContact NH1-CD 3.27Å; R301-E325 IonicContact NH1-OE1 2.95Å; R301-E325 PolarHBondContact NH1-OE1 3.23Å; R301-E325 VanDerWaalsContact NH1-OE1 3.14Å; R301-E325 IonicContact NH1-OE2 3.19Å; R301-E325 PolarHBondContact NH1-OE2 3.06Å; R301-E325 IonicContact NH2-OE1 3.11Å; R301-E325 PolarHBondContact NH2-OE1 3.37Å; R301-E325 IonicContact NH2-OE2 3.19Å; R301-F456 HydrophobicContact CB-CZ 4.5Å
302	K	93.9	Very high	95.6	Very high	130 Å²	130	46.5 Å²	46.5	57%	0.565	22%	0.223	S	C	*	.			trans	-78.3	114.5	171.8	-175.2	171	174.2	178.5	0	109.4	I275 N460	I275-K302 HydrophobicContact CD1-CB 3.91Å; K302-N460 PolarHBondContact O-ND2 2.67Å
303	L	94.8	Very high	95.8	Very high	11 Å²	11	41.7 Å²	41.7	6%	0.058	20%	0.2	C	C	.	.			trans	-96.5	132.8	169.3	-58.1	-175.7	0	0	0	109	D274 R301 V309 F456	D274-L303 HydrophobicContact CB-CB 4.07Å; D274-L303 HydrophobicContact CB-CD1 4.09Å; D274-L303 HydrophobicContact CB-CG 4.06Å; D274-L303 PolarHBondContact OD1-N 3.31Å; R301-L303 PolarHBondContact O-N 2.86Å; L303-V309 HydrophobicContact CD1-CG1 4.38Å; L303-V309 HydrophobicContact CD1-CG2 4.04Å; L303-V309 HydrophobicContact CD2-CG2 4.01Å; L303-F456 HydrophobicContact CD2-CE2 3.78Å; L303-F456 HydrophobicContact CD2-CZ 3.93Å
304	H	93.6	Very high	95.7	Very high	57 Å²	57	36.9 Å²	36.9	26%	0.264	18%	0.184	S	C	.	.	S	Bend	trans	-77.9	-26.7	173.2	-68.3	133.8	0	0	0	111.8	R355 N460 A463 I464	H304-R355 PolarHBondContact O-NH1 3.44Å; H304-R355 PolarHBondContact O-NH2 3.43Å; H304-N460 PolarHBondContact N-OD1 2.98Å; H304-N460 PolarHBondContact ND1-O 3.1Å; H304-N460 PolarHBondContact ND1-OD1 2.82Å; H304-A463 HydrophobicContact CB-CB 3.82Å; H304-I464 VanDerWaalsContact CE1-CG1 3.48Å; H304-I464 WeakPolarHBondContact CE1-CG1 3.44Å; H304-I464 VanDerWaalsContact ND1-CG1 3.29Å; H304-I464 WeakPolarHBondContact ND1-CG1 3.47Å
305	V	93.9	Very high	95.6	Very high	6 Å²	6	37.4 Å²	37.4	4%	0.036	19%	0.189	C	C	.	.	S	Bend	trans	-141.6	140.7	178.1	67.7	0	0	0	0	110.6	I331 R355 L356 C359 F459 A463	V305-I331 HydrophobicContact CG1-CD1 4.17Å; V305-R355 HydrophobicContact CG2-CB 4.07Å; V305-L356 HydrophobicContact CG2-CD2 3.93Å; V305-L356 HydrophobicContact CG2-CG 4.22Å; V305-C359 HydrophobicContact CG1-CB 3.63Å; V305-C359 HydrophobicContact CG2-CB 4.34Å; V305-F459 HydrophobicContact CG1-CE2 3.85Å; V305-F459 HydrophobicContact CG1-CZ 3.62Å; V305-A463 HydrophobicContact CB-CB 3.88Å; V305-A463 HydrophobicContact CG1-CB 3.31Å
306	G	95.1	Very high	95.4	Very high	6 Å²	6	36.3 Å²	36.3	6%	0.062	19%	0.189	C	C	.	.			trans	74.6	163.5	-173.5	0	0	0	0	0	113.1
307	D	95.8	Very high	95	Very high	23 Å²	23	37.4 Å²	37.4	12%	0.123	20%	0.196	C	C	.	.	S	Bend	trans	-102.4	-27.9	179.5	-59	-52.1	0	0	0	111.6	D274 E277 V332 E333 R334	D274-D307 PolarHBondContact N-O 3.26Å; E277-D307 HydrophobicContact CG-CB 3.92Å; D307-V332 PolarHBondContact N-O 3.27Å; D307-E333 WeakPolarHBondContact OD2-CA 3.48Å; D307-R334 HydrophobicContact CB-CB 4.49Å; D307-R334 PolarHBondContact OD2-N 2.91Å
308	F	98.1	Very high	94.5	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	139	176.1	-45.1	-90.6	0	0	0	112.1	L271 C272 V273 E277 L287 V332 R334 L412	L271-F308 HydrophobicContact CD1-CB 4Å; L271-F308 HydrophobicContact CD1-CD1 4.26Å; C272-F308 WeakPolarHBondContact O-CA 3.48Å; V273-F308 HydrophobicContact CB-CD1 4.28Å; V273-F308 HydrophobicContact CB-CE1 4.27Å; V273-F308 HydrophobicContact CG1-CD1 4.15Å; V273-F308 HydrophobicContact CG1-CE1 3.68Å; V273-F308 HydrophobicContact CG2-CD1 3.98Å; V273-F308 HydrophobicContact CG2-CE1 4.06Å; E277-F308 HydrophobicContact CB-CZ 4.44Å; E277-F308 HydrophobicContact CG-CE2 4.4Å; E277-F308 HydrophobicContact CG-CZ 3.95Å; L287-F308 HydrophobicContact CD2-CE1 3.7Å; L287-F308 HydrophobicContact CD2-CZ 3.5Å; F308-V332 HydrophobicContact CB-CB 3.98Å; F308-V332 HydrophobicContact CB-CG2 4.27Å; F308-V332 HydrophobicContact CD2-CB 3.94Å; F308-V332 HydrophobicContact CD2-CG1 3.97Å; F308-V332 HydrophobicContact CG-CB 4.42Å; F308-V332 PolarHBondContact N-O 2.66Å; F308-V332 VanDerWaalsContact N-O 3.09Å; F308-V332 PolarHBondContact O-N 2.7Å; F308-R334 HydrophobicContact CE2-CB 3.76Å; F308-L412 HydrophobicContact CB-CD2 4.36Å; F308-L412 HydrophobicContact CD1-CD1 3.85Å; F308-L412 HydrophobicContact CD1-CD2 4.46Å; F308-L412 HydrophobicContact CD2-CD1 4.26Å; F308-L412 HydrophobicContact CD2-CD2 4.25Å; F308-L412 HydrophobicContact CE1-CD1 3.67Å; F308-L412 HydrophobicContact CE2-CD1 4.13Å; F308-L412 HydrophobicContact CG-CD1 4.15Å; F308-L412 HydrophobicContact CG-CD2 4.08Å; F308-L412 HydrophobicContact CZ-CD1 3.84Å
309	V	98.2	Very high	94.1	Very high	0 Å²	0	47 Å²	47	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	169.5	169.5	-63.4	0	0	0	0	109.3	C272 L303 V327 I331 L361 F456 F459	C272-V309 HydrophobicContact CB-CG2 3.72Å; C272-V309 PolarHBondContact N-O 2.72Å; C272-V309 PolarHBondContact O-N 2.72Å; C272-V309 VanDerWaalsContact O-N 3.08Å; L303-V309 HydrophobicContact CD1-CG1 4.38Å; L303-V309 HydrophobicContact CD1-CG2 4.04Å; L303-V309 HydrophobicContact CD2-CG2 4.01Å; V309-V327 HydrophobicContact CB-CG2 4.15Å; V309-V327 HydrophobicContact CG2-CG2 4.35Å; V309-I331 HydrophobicContact CG1-CB 4.17Å; V309-I331 HydrophobicContact CG1-CD1 4.12Å; V309-I331 HydrophobicContact CG1-CG1 3.84Å; V309-L361 HydrophobicContact CG1-CD1 4.18Å; V309-F456 HydrophobicContact CG2-CE2 4.44Å; V309-F459 HydrophobicContact CG1-CE1 4.14Å; V309-F459 HydrophobicContact CG1-CZ 4.01Å
310	W	98.4	Very high	93.6	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	139.7	171.5	-69.5	-96.7	0	0	0	110.2	V269 L270 L271 L328 H330 V332 L412 L415 T416 L419	V269-W310 HydrophobicContact CG1-CB 4.22Å; L270-W310 WeakPolarHBondContact O-CA 3.48Å; L271-W310 HydrophobicContact CD1-CD2 4.35Å; L271-W310 HydrophobicContact CD1-CH2 4.45Å; L271-W310 HydrophobicContact CD1-CZ2 3.75Å; W310-L328 HydrophobicContact CB-CB 4.07Å; W310-L328 HydrophobicContact CB-CD2 3.97Å; W310-L328 HydrophobicContact CB-CG 4.46Å; W310-L328 PolarHBondContact O-N 2.86Å; W310-H330 HydrophobicContact CE3-CB 3.69Å; W310-H330 HydrophobicContact CZ3-CB 3.77Å; W310-V332 HydrophobicContact CH2-CG2 3.54Å; W310-V332 HydrophobicContact CZ3-CG2 3.74Å; W310-L412 HydrophobicContact CH2-CD2 4.29Å; W310-L412 HydrophobicContact CZ2-CD2 4.35Å; W310-L415 HydrophobicContact CH2-CD2 3.25Å; W310-L415 HydrophobicContact CH2-CG 3.76Å; W310-L415 HydrophobicContact CZ2-CB 4.12Å; W310-L415 HydrophobicContact CZ2-CD2 3.68Å; W310-L415 HydrophobicContact CZ2-CG 3.68Å; W310-L415 HydrophobicContact CZ3-CD2 4.05Å; W310-T416 PolarHBondContact NE1-OG1 2.96Å; W310-L419 HydrophobicContact CB-CD1 4.16Å; W310-L419 HydrophobicContact CD2-CD1 3.34Å; W310-L419 HydrophobicContact CE3-CD1 3.74Å; W310-L419 HydrophobicContact CG-CD1 3.52Å; W310-L419 HydrophobicContact CZ2-CD1 4.3Å; W310-L419 HydrophobicContact CZ3-CD1 4.37Å
311	V	97.6	Very high	93.1	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	133.6	176.6	-62.4	0	0	0	0	109.7	V269 L270 L326 F456	V269-V311 WeakPolarHBondContact CA-O 3.35Å; L270-V311 HydrophobicContact CD1-CG2 4.07Å; L270-V311 HydrophobicContact CD2-CG2 3.9Å; L270-V311 HydrophobicContact CG-CG2 3.68Å; L270-V311 PolarHBondContact N-O 3.26Å; L270-V311 PolarHBondContact O-N 3.11Å; V311-L326 CarbonylContact C-O 3.53Å; V311-L326 WeakPolarHBondContact CA-O 3.48Å; V311-F456 HydrophobicContact CG1-CB 4.41Å; V311-F456 HydrophobicContact CG1-CD2 3.65Å; V311-F456 HydrophobicContact CG1-CE2 4.31Å; V311-F456 HydrophobicContact CG1-CG 4.28Å
312	A	97.3	Very high	92.7	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	107.5	161.8	0	0	0	0	0	107.3	L262 Y267 R268 E325 L326 L328 L428	L262-A312 HydrophobicContact CD1-CB 4.28Å; Y267-A312 HydrophobicContact CD2-CB 3.79Å; Y267-A312 HydrophobicContact CE2-CB 4.34Å; Y267-A312 HydrophobicContact CG-CB 4.34Å; R268-A312 WeakPolarHBondContact O-CA 3.46Å; A312-E325 WeakPolarHBondContact O-CA 3.28Å; A312-L326 HydrophobicContact CB-CB 4.45Å; A312-L326 PolarHBondContact N-O 3.47Å; A312-L326 PolarHBondContact O-N 3.21Å; A312-L328 HydrophobicContact CB-CD1 3.92Å; A312-L428 HydrophobicContact CB-CD1 3.33Å
313	Q	96.4	Very high	92.7	Very high	18 Å²	18	48.6 Å²	48.6	8%	0.084	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	132	-178.3	-179	-179.8	63.5	0	0	109.4	Y267 R268 L270 P323 E325	Y267-Q313 CarbonylContact C-O 3.54Å; Y267-Q313 WeakPolarHBondContact CA-O 3.42Å; Y267-Q313 WeakPolarHBondContact CB-O 3.39Å; R268-Q313 PolarHBondContact N-O 3.41Å; R268-Q313 PolarHBondContact O-N 3.2Å; L270-Q313 HydrophobicContact CD2-CB 3.52Å; L270-Q313 HydrophobicContact CD2-CG 4.48Å; Q313-P323 HydrophobicContact CG-CB 4.09Å; Q313-P323 HydrophobicContact CG-CG 4.26Å; Q313-E325 HydrophobicContact CB-CG 4.15Å; Q313-E325 HydrophobicContact CG-CG 3.98Å; Q313-E325 PolarHBondContact NE2-OE1 3.03Å
314	E	95.6	Very high	92.6	Very high	46 Å²	46	48.6 Å²	48.6	22%	0.215	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-53.6	136.2	174.1	-168.6	177.2	-167.9	0	0	111.6	L262 E266 P317 G324	L262-E314 HydrophobicContact CD2-CB 3.98Å; L262-E314 HydrophobicContact CD2-CG 4.14Å; E266-E314 CarbonylContact O-C 3.59Å; E266-E314 WeakPolarHBondContact O-CA 3.5Å; E314-P317 VanDerWaalsContact CD-CA 3.46Å; E314-P317 HydrophobicContact CG-CB 4.37Å; E314-P317 WeakPolarHBondContact OE2-CA 3.16Å; E314-P317 WeakPolarHBondContact OE2-CB 3.35Å; E314-G324 PolarHBondContact N-O 2.63Å; E314-G324 PolarHBondContact OE2-N 2.95Å; E314-G324 VanDerWaalsContact OE2-N 3.09Å
315	T	93.1	Very high	92.7	Very high	42 Å²	42	47.1 Å²	47.1	26%	0.258	26%	0.264	S	S	.	.	S	Bend	trans	-81.1	-39.1	-179.4	48.3	0	0	0	0	112.4	G265 E266 R268 P317	G265-T315 PolarHBondContact O-OG1 3.09Å; E266-T315 VanDerWaalsContact C-OG1 3.28Å; E266-T315 PolarHBondContact O-N 3.18Å; E266-T315 PolarHBondContact O-OG1 3.49Å; E266-T315 VanDerWaalsContact O-OG1 3.13Å; R268-T315 HydrophobicContact CB-CG2 4.37Å; R268-T315 HydrophobicContact CG-CG2 4.36Å; T315-P317 WeakPolarHBondContact O-CD 3.33Å
316	N	91.3	Very high	92.8	Very high	140 Å²	140	46.8 Å²	46.8	75%	0.749	26%	0.263	S	S	*	.	S	Bend	trans	-126.3	70.4	-175.8	-63.6	-32.3	0	0	0	111
317	P	88.6	Confident	92.9	Very high	33 Å²	33	46.5 Å²	46.5	21%	0.214	26%	0.26	C	S	.	.			trans	-69.9	147.7	-177.6	33.4	-39.1	0	0	0	112.1	E314 T315 D319 P323	E314-P317 VanDerWaalsContact CD-CA 3.46Å; E314-P317 HydrophobicContact CG-CB 4.37Å; E314-P317 WeakPolarHBondContact OE2-CA 3.16Å; E314-P317 WeakPolarHBondContact OE2-CB 3.35Å; T315-P317 WeakPolarHBondContact O-CD 3.33Å; P317-D319 PolarHBondContact O-N 3.09Å; P317-P323 HydrophobicContact CB-CB 3.97Å; P317-P323 HydrophobicContact CG-CB 4.07Å
318	R	83.4	Confident	92.9	Very high	252 Å²	252	45.4 Å²	45.4	95%	0.951	25%	0.254	S	S	*	.	S	Bend	trans	-60.9	-37.3	172.6	-66.4	-177.2	-179.4	177.5	0.4	112
319	D	87	Confident	92.7	Very high	74 Å²	74	45.7 Å²	45.7	40%	0.396	26%	0.255	S	S	.	.	S	Bend	trans	-117.2	111	171.5	174.7	17.9	0	0	0	109.6	P317 A321 S322	P317-D319 PolarHBondContact O-N 3.09Å; D319-A321 PolarHBondContact O-N 3.17Å; D319-A321 VanDerWaalsContact O-N 3.14Å; D319-A321 WeakPolarHBondContact OD1-CB 3.41Å; D319-A321 PolarHBondContact OD1-N 3.48Å; D319-S322 CarbonylContact O-C 3.42Å; D319-S322 PolarHBondContact O-N 3.06Å; D319-S322 PolarHBondContact OD2-OG 2.87Å
320	P	85.9	Confident	92.6	Very high	112 Å²	112	46.8 Å²	46.8	73%	0.727	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-23.5	175.8	-25.2	34.8	0	0	0	114.5	S322	P320-S322 VanDerWaalsContact C-N 3.34Å
321	A	84.6	Confident	92.6	Very high	88 Å²	88	46.8 Å²	46.8	73%	0.727	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.1	-21.9	177.6	0	0	0	0	0	112.9	D319	D319-A321 PolarHBondContact O-N 3.17Å; D319-A321 VanDerWaalsContact O-N 3.14Å; D319-A321 WeakPolarHBondContact OD1-CB 3.41Å; D319-A321 PolarHBondContact OD1-N 3.48Å
322	S	85.3	Confident	92.6	Very high	78 Å²	78	46.8 Å²	46.8	55%	0.545	26%	0.26	S	S	.	.	S	Bend	trans	-137.4	66.6	-175.3	61.6	0	0	0	0	112.4	D319 P320	D319-S322 CarbonylContact O-C 3.42Å; D319-S322 PolarHBondContact O-N 3.06Å; D319-S322 PolarHBondContact OD2-OG 2.87Å; P320-S322 VanDerWaalsContact C-N 3.34Å
323	P	92.1	Very high	92.6	Very high	34 Å²	34	47.5 Å²	47.5	22%	0.221	26%	0.264	C	S	.	.			trans	-62.1	144.6	177.4	26.6	-34	0	0	0	111.9	Q313 P317 E325	Q313-P323 HydrophobicContact CG-CB 4.09Å; Q313-P323 HydrophobicContact CG-CG 4.26Å; P317-P323 HydrophobicContact CB-CB 3.97Å; P317-P323 HydrophobicContact CG-CB 4.07Å; P323-E325 PolarHBondContact O-N 2.68Å
324	G	93	Very high	92.6	Very high	12 Å²	12	47.5 Å²	47.5	12%	0.124	26%	0.263	C	S	.	.			trans	-61.2	126.3	171	0	0	0	0	0	111.3	E314	E314-G324 PolarHBondContact N-O 2.63Å; E314-G324 PolarHBondContact OE2-N 2.95Å; E314-G324 VanDerWaalsContact OE2-N 3.09Å
325	E	95.6	Very high	92.4	Very high	25 Å²	25	46.1 Å²	46.1	12%	0.117	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	122.7	-175.7	-72.3	-179.9	161.8	0	0	113.3	R301 A312 Q313 P323 T455 F456	R301-E325 IonicContact CZ-OE1 3.64Å; R301-E325 IonicContact CZ-OE2 3.72Å; R301-E325 VanDerWaalsContact NH1-CD 3.27Å; R301-E325 IonicContact NH1-OE1 2.95Å; R301-E325 PolarHBondContact NH1-OE1 3.23Å; R301-E325 VanDerWaalsContact NH1-OE1 3.14Å; R301-E325 IonicContact NH1-OE2 3.19Å; R301-E325 PolarHBondContact NH1-OE2 3.06Å; R301-E325 IonicContact NH2-OE1 3.11Å; R301-E325 PolarHBondContact NH2-OE1 3.37Å; R301-E325 IonicContact NH2-OE2 3.19Å; A312-E325 WeakPolarHBondContact O-CA 3.28Å; Q313-E325 HydrophobicContact CB-CG 4.15Å; Q313-E325 HydrophobicContact CG-CG 3.98Å; Q313-E325 PolarHBondContact NE2-OE1 3.03Å; P323-E325 PolarHBondContact O-N 2.68Å; E325-T455 WeakPolarHBondContact O-CA 3.3Å; E325-F456 HydrophobicContact CB-CB 3.98Å; E325-F456 PolarHBondContact O-N 3.46Å
326	L	96.3	Very high	92.3	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	129.3	174.8	-62.1	177.9	0	0	0	110.2	L260 L262 V311 A312 L428 L453 L454 T455	L260-L326 HydrophobicContact CD2-CD2 3.9Å; L260-L326 HydrophobicContact CD2-CG 3.96Å; L260-L326 HydrophobicContact CG-CD2 4.5Å; L262-L326 HydrophobicContact CD1-CD1 4.02Å; L262-L326 HydrophobicContact CD1-CG 4.14Å; L262-L326 HydrophobicContact CG-CD1 4.3Å; V311-L326 CarbonylContact C-O 3.53Å; V311-L326 WeakPolarHBondContact CA-O 3.48Å; A312-L326 HydrophobicContact CB-CB 4.45Å; A312-L326 PolarHBondContact N-O 3.47Å; A312-L326 PolarHBondContact O-N 3.21Å; L326-L428 HydrophobicContact CD1-CB 3.61Å; L326-L453 HydrophobicContact CB-CB 3.97Å; L326-L453 HydrophobicContact CB-CD1 4.09Å; L326-L454 CarbonylContact C-O 3.57Å; L326-L454 WeakPolarHBondContact CA-O 3.39Å; L326-T455 HydrophobicContact CD2-CG2 4.24Å
327	V	96.8	Very high	92.1	Very high	0 Å²	0	41 Å²	41	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84	127.4	176.9	63.5	0	0	0	0	110	V309 L361 L454 F459	V309-V327 HydrophobicContact CB-CG2 4.15Å; V309-V327 HydrophobicContact CG2-CG2 4.35Å; V327-L361 HydrophobicContact CG1-CD2 4.01Å; V327-L361 HydrophobicContact CG2-CD1 4Å; V327-L361 HydrophobicContact CG2-CD2 4.33Å; V327-L454 HydrophobicContact CG1-CB 3.74Å; V327-L454 WeakPolarHBondContact CG1-O 3.44Å; V327-L454 PolarHBondContact N-O 3.31Å; V327-F459 HydrophobicContact CG1-CB 3.66Å; V327-F459 HydrophobicContact CG1-CD2 4.45Å; V327-F459 HydrophobicContact CG1-CG 3.97Å; V327-F459 HydrophobicContact CG2-CD1 4.39Å; V327-F459 HydrophobicContact CG2-CG 4.47Å
328	L	96.3	Very high	92	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	157.7	175.2	-87.4	62.9	0	0	0	110.3	V269 W310 A312 H330 L419 Y423 L453	V269-L328 HydrophobicContact CG1-CD2 3.77Å; V269-L328 HydrophobicContact CG2-CD2 4.46Å; W310-L328 HydrophobicContact CB-CB 4.07Å; W310-L328 HydrophobicContact CB-CD2 3.97Å; W310-L328 HydrophobicContact CB-CG 4.46Å; W310-L328 PolarHBondContact O-N 2.86Å; A312-L328 HydrophobicContact CB-CD1 3.92Å; L328-H330 PolarHBondContact O-N 3.29Å; L328-L419 HydrophobicContact CD2-CB 4.19Å; L328-L419 HydrophobicContact CD2-CD1 4.26Å; L328-L419 HydrophobicContact CD2-CD2 4.38Å; L328-Y423 HydrophobicContact CD2-CD2 3.66Å; L328-Y423 HydrophobicContact CD2-CE2 3.41Å; L328-Y423 VanDerWaalsContact CD2-CE2 3.41Å; L328-Y423 HydrophobicContact CD2-CG 4.39Å; L328-Y423 HydrophobicContact CG-CD2 4.36Å; L328-Y423 HydrophobicContact CG-CE1 4.33Å; L328-Y423 HydrophobicContact CG-CE2 3.83Å; L328-L453 HydrophobicContact CD1-CD1 4.1Å; L328-L453 HydrophobicContact CG-CD1 4.44Å
329	D	94.7	Very high	92.2	Very high	6 Å²	6	32.4 Å²	32.4	3%	0.032	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	0.6	-174.9	-161.9	35.5	0	0	0	115.5	E362 R363 L450	D329-E362 PolarHBondContact OD1-N 3.48Å; D329-R363 HydrophobicContact CB-CG 4.45Å; D329-R363 WeakPolarHBondContact O-CA 3.49Å; D329-R363 VanDerWaalsContact O-CB 3.29Å; D329-R363 WeakPolarHBondContact O-CB 3.4Å; D329-R363 PolarHBondContact O-N 3.09Å; D329-R363 WeakPolarHBondContact OD2-CG 3.4Å; D329-L450 HydrophobicContact CB-CB 4.37Å; D329-L450 HydrophobicContact CB-CD2 3.9Å
330	H	96.4	Very high	92.4	Very high	23 Å²	23	28.9 Å²	28.9	11%	0.106	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	130.1	-175.1	-63.7	69.8	0	0	0	111.6	W310 L328 R363 L419	W310-H330 HydrophobicContact CE3-CB 3.69Å; W310-H330 HydrophobicContact CZ3-CB 3.77Å; L328-H330 PolarHBondContact O-N 3.29Å; H330-R363 WeakPolarHBondContact CA-O 2.99Å; H330-R363 HydrophobicContact CB-CB 4.46Å; H330-L419 HydrophobicContact CB-CD1 4.42Å
331	I	97.8	Very high	92.5	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	136.7	175.3	-174.5	163.7	0	0	0	110.2	V305 V309 L356 L361 R363 R364 V365 F459	V305-I331 HydrophobicContact CG1-CD1 4.17Å; V309-I331 HydrophobicContact CG1-CB 4.17Å; V309-I331 HydrophobicContact CG1-CD1 4.12Å; V309-I331 HydrophobicContact CG1-CG1 3.84Å; I331-L356 HydrophobicContact CD1-CD2 3.6Å; I331-L356 HydrophobicContact CG1-CD2 3.94Å; I331-L356 HydrophobicContact CG2-CD2 4.41Å; I331-L361 HydrophobicContact CB-CB 4.38Å; I331-L361 HydrophobicContact CB-CD1 3.85Å; I331-L361 HydrophobicContact CD1-CD1 4.25Å; I331-L361 HydrophobicContact CG2-CB 4.05Å; I331-L361 HydrophobicContact CG2-CD1 4.43Å; I331-R363 PolarHBondContact N-O 2.88Å; I331-R364 HydrophobicContact CG2-CB 4.31Å; I331-R364 HydrophobicContact CG2-CG 3.99Å; I331-V365 PolarHBondContact O-N 3.32Å; I331-F459 HydrophobicContact CD1-CE2 4.34Å; I331-F459 HydrophobicContact CD1-CZ 4.02Å
332	V	98.3	Very high	92.6	Very high	0 Å²	0	22 Å²	22	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	131.8	178	-174	0	0	0	0	109.6	D307 F308 W310 V365 L367 L412	D307-V332 PolarHBondContact N-O 3.27Å; F308-V332 HydrophobicContact CB-CB 3.98Å; F308-V332 HydrophobicContact CB-CG2 4.27Å; F308-V332 HydrophobicContact CD2-CB 3.94Å; F308-V332 HydrophobicContact CD2-CG1 3.97Å; F308-V332 HydrophobicContact CG-CB 4.42Å; F308-V332 PolarHBondContact N-O 2.66Å; F308-V332 VanDerWaalsContact N-O 3.09Å; F308-V332 PolarHBondContact O-N 2.7Å; W310-V332 HydrophobicContact CH2-CG2 3.54Å; W310-V332 HydrophobicContact CZ3-CG2 3.74Å; V332-V365 WeakPolarHBondContact CA-O 3.28Å; V332-V365 HydrophobicContact CB-CB 4.37Å; V332-V365 HydrophobicContact CG1-CB 4.38Å; V332-V365 HydrophobicContact CG1-CG1 4.18Å; V332-V365 HydrophobicContact CG2-CB 3.97Å; V332-V365 HydrophobicContact CG2-CG1 4.26Å; V332-L367 HydrophobicContact CG1-CB 3.75Å; V332-L367 HydrophobicContact CG1-CD2 4.38Å; V332-L412 HydrophobicContact CG2-CD2 4.23Å
333	E	97.1	Very high	92.8	Very high	15 Å²	15	18.3 Å²	18.3	7%	0.07	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	118	162	-176.7	91.9	172.2	0	0	107.8	D307 L356 V365 Y366 L367	D307-E333 WeakPolarHBondContact OD2-CA 3.48Å; E333-L356 HydrophobicContact CB-CD1 3.72Å; E333-L356 HydrophobicContact CG-CD1 4.1Å; E333-V365 PolarHBondContact N-O 3.08Å; E333-Y366 HydrophobicContact CB-CD2 4.09Å; E333-Y366 HydrophobicContact CB-CE2 4.26Å; E333-Y366 HydrophobicContact CG-CD2 4.3Å; E333-Y366 HydrophobicContact CG-CE2 3.95Å; E333-L367 PolarHBondContact O-N 3.44Å
334	R	94.8	Very high	92.5	Very high	18 Å²	18	19 Å²	19	7%	0.068	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	132.2	174.6	174.8	173.1	167.6	-85.2	-0.3	109.5	E277 D307 F308 L367 E369	E277-R334 IonicContact OE1-NH1 2.67Å; E277-R334 WeakPolarHBondContact OE2-CD 3.38Å; E277-R334 IonicContact OE2-CZ 3.47Å; E277-R334 IonicContact OE2-NE 2.86Å; E277-R334 IonicContact OE2-NH1 3.12Å; E277-R334 PolarHBondContact OE2-NH1 2.97Å; D307-R334 HydrophobicContact CB-CB 4.49Å; D307-R334 PolarHBondContact OD2-N 2.91Å; F308-R334 HydrophobicContact CE2-CB 3.76Å; R334-L367 CarbonylContact C-O 3.45Å; R334-L367 WeakPolarHBondContact CA-O 3.46Å; R334-L367 HydrophobicContact CB-CB 4.41Å; R334-L367 HydrophobicContact CB-CD2 4.38Å; R334-L367 HydrophobicContact CG-CD2 4.33Å; R334-E369 IonicContact CZ-OE1 2.66Å; R334-E369 IonicContact CZ-OE2 3.39Å; R334-E369 VanDerWaalsContact CZ-OE2 3.29Å; R334-E369 IonicContact NE-OE1 3.34Å; R334-E369 IonicContact NE-OE2 2.78Å; R334-E369 PolarHBondContact NE-OE2 3.29Å; R334-E369 IonicContact NH2-OE1 3.74Å; R334-E369 PolarHBondContact NH2-OE1 2.86Å; R334-E369 IonicContact NH2-OE2 3.11Å; R334-E369 PolarHBondContact NH2-OE2 3.01Å
335	K	92.5	Very high	91.9	Very high	16 Å²	16	22.3 Å²	22.3	7%	0.07	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	112	-179.1	-150.8	78.5	177.7	-175.7	0	110.8	D339 L340 S343 Y366 L367 V368 E369	K335-D339 WeakPolarHBondContact CE-O 3.15Å; K335-L340 HydrophobicContact CG-CB 3.81Å; K335-L340 HydrophobicContact CG-CD1 4.28Å; K335-S343 WeakPolarHBondContact CE-OG 3.35Å; K335-S343 PolarHBondContact NZ-OG 3.26Å; K335-Y366 HydrophobicContact CB-CE1 3.79Å; K335-Y366 HydrophobicContact CG-CE1 4.39Å; K335-Y366 WeakPolarHBondContact CG-OH 3.46Å; K335-L367 PolarHBondContact N-O 3.05Å; K335-V368 WeakPolarHBondContact O-CA 3.41Å; K335-E369 PolarHBondContact O-N 3.28Å
336	R	89.9	Confident	91.2	Very high	53 Å²	53	24.6 Å²	24.6	20%	0.2	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	149.5	166	-63.5	173.4	60.2	-121.5	-11.4	109.7	D338 D339 L340 E369	R336-D338 VanDerWaalsContact C-N 3.3Å; R336-D338 WeakPolarHBondContact CB-OD1 3.46Å; R336-D338 IonicContact CZ-OD1 4Å; R336-D338 IonicContact CZ-OD2 2.64Å; R336-D338 IonicContact NE-OD1 3.94Å; R336-D338 IonicContact NH1-OD1 2.66Å; R336-D338 PolarHBondContact NH1-OD1 3.45Å; R336-D338 IonicContact NH1-OD2 3.96Å; R336-D338 PolarHBondContact NH1-OD2 3.44Å; R336-D338 VanDerWaalsContact NH2-CG 3.31Å; R336-D338 IonicContact NH2-OD1 2.76Å; R336-D338 PolarHBondContact NH2-OD1 2.83Å; R336-D338 VanDerWaalsContact NH2-OD1 3.12Å; R336-D338 IonicContact NH2-OD2 3.26Å; R336-D338 PolarHBondContact NH2-OD2 2.95Å; R336-D338 PolarHBondContact O-N 2.99Å; R336-D339 HydrophobicContact CB-CB 4.35Å; R336-D339 IonicContact NH1-OD2 3.95Å; R336-D339 CarbonylContact O-C 3.58Å; R336-D339 WeakPolarHBondContact O-CB 3.21Å; R336-D339 PolarHBondContact O-N 3.25Å; R336-D339 VanDerWaalsContact O-N 3.11Å; R336-L340 PolarHBondContact O-N 3.11Å; R336-E369 WeakPolarHBondContact CA-O 3.45Å; R336-E369 HydrophobicContact CG-CB 4.42Å
337	L	88.3	Confident	90.3	Very high	21 Å²	21	26.7 Å²	26.7	11%	0.11	15%	0.149	C	C	.	.	H	α-helix	trans	-62.8	-34.2	-173.7	-160.4	61.6	0	0	0	113.3	L340 C341 V368 E369 V374 L377 L384	L337-L340 HydrophobicContact CD1-CD2 4.22Å; L337-L340 PolarHBondContact O-N 2.95Å; L337-C341 PolarHBondContact O-N 3.09Å; L337-C341 PolarHBondContact O-SG 3.41Å; L337-V368 HydrophobicContact CD1-CG1 4.43Å; L337-E369 PolarHBondContact N-O 3.17Å; L337-V374 HydrophobicContact CD2-CG1 4.48Å; L337-V374 HydrophobicContact CD2-CG2 4.27Å; L337-L377 HydrophobicContact CB-CD1 4.41Å; L337-L377 HydrophobicContact CD2-CD1 3.55Å; L337-L377 HydrophobicContact CG-CD1 3.63Å; L337-L384 HydrophobicContact CD1-CB 4.33Å; L337-L384 HydrophobicContact CD1-CD1 3.98Å; L337-L384 HydrophobicContact CD2-CD1 4.45Å; L337-L384 HydrophobicContact CG-CD1 4.04Å
338	D	85.5	Confident	89.6	Confident	52 Å²	52	32.7 Å²	32.7	28%	0.278	17%	0.171	S	C	.	.	H	α-helix	trans	-67.5	-40.9	172.1	55.8	-37.5	0	0	0	112.7	R336 L340 C341 S342 L377	R336-D338 VanDerWaalsContact C-N 3.3Å; R336-D338 WeakPolarHBondContact CB-OD1 3.46Å; R336-D338 IonicContact CZ-OD1 4Å; R336-D338 IonicContact CZ-OD2 2.64Å; R336-D338 IonicContact NE-OD1 3.94Å; R336-D338 IonicContact NH1-OD1 2.66Å; R336-D338 PolarHBondContact NH1-OD1 3.45Å; R336-D338 IonicContact NH1-OD2 3.96Å; R336-D338 PolarHBondContact NH1-OD2 3.44Å; R336-D338 VanDerWaalsContact NH2-CG 3.31Å; R336-D338 IonicContact NH2-OD1 2.76Å; R336-D338 PolarHBondContact NH2-OD1 2.83Å; R336-D338 VanDerWaalsContact NH2-OD1 3.12Å; R336-D338 IonicContact NH2-OD2 3.26Å; R336-D338 PolarHBondContact NH2-OD2 2.95Å; R336-D338 PolarHBondContact O-N 2.99Å; D338-L340 VanDerWaalsContact C-N 3.34Å; D338-C341 WeakPolarHBondContact O-CB 3.09Å; D338-C341 PolarHBondContact O-N 2.93Å; D338-S342 PolarHBondContact O-N 3.5Å; D338-S342 VanDerWaalsContact O-N 3.1Å; D338-S342 PolarHBondContact O-OG 3.04Å; D338-S342 VanDerWaalsContact O-OG 3.07Å; D338-L377 HydrophobicContact CB-CD2 4.06Å
339	D	88.8	Confident	89.2	Confident	54 Å²	54	33.5 Å²	33.5	29%	0.289	18%	0.175	S	C	.	.	H	α-helix	trans	-67.4	-35.1	174.1	-73.4	-44.6	0	0	0	111.7	K335 R336 S343	K335-D339 WeakPolarHBondContact CE-O 3.15Å; R336-D339 HydrophobicContact CB-CB 4.35Å; R336-D339 IonicContact NH1-OD2 3.95Å; R336-D339 CarbonylContact O-C 3.58Å; R336-D339 WeakPolarHBondContact O-CB 3.21Å; R336-D339 PolarHBondContact O-N 3.25Å; R336-D339 VanDerWaalsContact O-N 3.11Å; D339-S343 VanDerWaalsContact O-CB 3.27Å; D339-S343 WeakPolarHBondContact O-CB 3.29Å; D339-S343 PolarHBondContact O-N 3.32Å; D339-S343 PolarHBondContact O-OG 3.24Å
340	L	89.7	Confident	88.8	Confident	0 Å²	0	43 Å²	43	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-63.5	-46.4	173.6	-179.9	60.1	0	0	0	110.9	K335 R336 L337 D338 S342 S343 I344 F349 L384 V388	K335-L340 HydrophobicContact CG-CB 3.81Å; K335-L340 HydrophobicContact CG-CD1 4.28Å; R336-L340 PolarHBondContact O-N 3.11Å; L337-L340 HydrophobicContact CD1-CD2 4.22Å; L337-L340 PolarHBondContact O-N 2.95Å; D338-L340 VanDerWaalsContact C-N 3.34Å; L340-S342 PolarHBondContact O-N 3.06Å; L340-S343 PolarHBondContact O-N 3.18Å; L340-I344 HydrophobicContact CD1-CD1 4.02Å; L340-I344 HydrophobicContact CD1-CG1 4.27Å; L340-I344 HydrophobicContact CG-CD1 3.98Å; L340-I344 WeakPolarHBondContact O-CG1 3.49Å; L340-I344 PolarHBondContact O-N 3.25Å; L340-F349 HydrophobicContact CD1-CD2 3.67Å; L340-F349 HydrophobicContact CD1-CE2 3.63Å; L340-F349 HydrophobicContact CD1-CG 4.47Å; L340-F349 HydrophobicContact CD1-CZ 4.38Å; L340-L384 HydrophobicContact CD2-CD2 4.09Å; L340-L384 HydrophobicContact CG-CD2 4.07Å; L340-V388 HydrophobicContact CD2-CG2 3.87Å
341	C	88.8	Confident	88.2	Confident	1 Å²	1	45.3 Å²	45.3	1%	0.007	22%	0.221	C	C	.	.	H	α-helix	trans	-55.2	-52.8	175.9	-68.4	0	0	0	0	111.3	L337 D338 S343 I344 I345 L379 L384	L337-C341 PolarHBondContact O-N 3.09Å; L337-C341 PolarHBondContact O-SG 3.41Å; D338-C341 WeakPolarHBondContact O-CB 3.09Å; D338-C341 PolarHBondContact O-N 2.93Å; C341-S343 VanDerWaalsContact C-N 3.29Å; C341-S343 PolarHBondContact O-N 3.31Å; C341-I344 PolarHBondContact O-N 3.13Å; C341-I345 WeakPolarHBondContact O-CG1 3.27Å; C341-I345 PolarHBondContact O-N 3.11Å; C341-I345 VanDerWaalsContact O-N 3.12Å; C341-L379 HydrophobicContact CB-CD1 4.43Å; C341-L384 VanDerWaalsContact SG-CD1 3.58Å; C341-L384 WeakPolarHBondContact SG-CD2 3.48Å
342	S	87.4	Confident	87.8	Confident	53 Å²	53	46.9 Å²	46.9	37%	0.371	23%	0.228	S	C	.	.	H	α-helix	trans	-58.5	-43.5	-179.8	-59.2	0	0	0	0	111.3	D338 L340 I344 I345 D346	D338-S342 PolarHBondContact O-N 3.5Å; D338-S342 VanDerWaalsContact O-N 3.1Å; D338-S342 PolarHBondContact O-OG 3.04Å; D338-S342 VanDerWaalsContact O-OG 3.07Å; L340-S342 PolarHBondContact O-N 3.06Å; S342-I344 VanDerWaalsContact C-N 3.33Å; S342-I344 PolarHBondContact O-N 2.97Å; S342-I345 PolarHBondContact O-N 2.83Å; S342-D346 PolarHBondContact O-N 2.71Å; S342-D346 VanDerWaalsContact O-OD2 3.06Å
343	S	88.2	Confident	87.4	Confident	2 Å²	2	47.4 Å²	47.4	1%	0.014	23%	0.231	C	C	.	.	H	α-helix	trans	-68.6	-28.8	-178.6	-57	0	0	0	0	113.6	K335 D339 L340 C341 D346 G347 R348 F349	K335-S343 WeakPolarHBondContact CE-OG 3.35Å; K335-S343 PolarHBondContact NZ-OG 3.26Å; D339-S343 VanDerWaalsContact O-CB 3.27Å; D339-S343 WeakPolarHBondContact O-CB 3.29Å; D339-S343 PolarHBondContact O-N 3.32Å; D339-S343 PolarHBondContact O-OG 3.24Å; L340-S343 PolarHBondContact O-N 3.18Å; C341-S343 VanDerWaalsContact C-N 3.29Å; C341-S343 PolarHBondContact O-N 3.31Å; S343-D346 VanDerWaalsContact CA-OD1 3.28Å; S343-D346 WeakPolarHBondContact CA-OD1 3.28Å; S343-D346 VanDerWaalsContact O-OD1 3.06Å; S343-G347 CarbonylContact O-C 3.58Å; S343-G347 PolarHBondContact O-N 2.78Å; S343-R348 PolarHBondContact O-N 3.4Å; S343-R348 VanDerWaalsContact O-N 3.09Å; S343-F349 VanDerWaalsContact O-CB 3.29Å; S343-F349 WeakPolarHBondContact O-CB 3.44Å; S343-F349 PolarHBondContact O-N 3.26Å
344	I	86.4	Confident	86.9	Confident	47 Å²	47	52.2 Å²	52.2	24%	0.241	25%	0.252	C	S	.	.	H	α-helix	trans	-72.5	-43.1	173.7	-69.7	166.1	0	0	0	109.8	L340 C341 S342 G347 F349 L379 L384 A387	L340-I344 HydrophobicContact CD1-CD1 4.02Å; L340-I344 HydrophobicContact CD1-CG1 4.27Å; L340-I344 HydrophobicContact CG-CD1 3.98Å; L340-I344 WeakPolarHBondContact O-CG1 3.49Å; L340-I344 PolarHBondContact O-N 3.25Å; C341-I344 PolarHBondContact O-N 3.13Å; S342-I344 VanDerWaalsContact C-N 3.33Å; S342-I344 PolarHBondContact O-N 2.97Å; I344-G347 PolarHBondContact O-N 3Å; I344-F349 HydrophobicContact CG1-CB 4.07Å; I344-F349 HydrophobicContact CG1-CD1 3.92Å; I344-F349 HydrophobicContact CG1-CE1 4.48Å; I344-F349 HydrophobicContact CG1-CG 3.96Å; I344-L379 HydrophobicContact CB-CD1 3.77Å; I344-L379 HydrophobicContact CD1-CD1 4.06Å; I344-L379 HydrophobicContact CG2-CD1 3.67Å; I344-L384 HydrophobicContact CD1-CD2 3.97Å; I344-A387 HydrophobicContact CD1-CB 3.71Å
345	I	81.6	Confident	86.6	Confident	82 Å²	82	53.6 Å²	53.6	42%	0.421	26%	0.257	S	S	.	.	H	α-helix	trans	-66	-43.1	-177.7	-66.9	166.6	0	0	0	111.5	C341 S342 L379	C341-I345 WeakPolarHBondContact O-CG1 3.27Å; C341-I345 PolarHBondContact O-N 3.11Å; C341-I345 VanDerWaalsContact O-N 3.12Å; S342-I345 PolarHBondContact O-N 2.83Å; I345-L379 HydrophobicContact CD1-CD2 4.29Å; I345-L379 HydrophobicContact CD1-CG 4.17Å; I345-L379 HydrophobicContact CG1-CD1 4.23Å; I345-L379 HydrophobicContact CG1-CD2 4.07Å; I345-L379 HydrophobicContact CG1-CG 4.19Å
346	D	80.1	Confident	86.6	Confident	73 Å²	73	53 Å²	53	39%	0.39	25%	0.254	S	S	.	.	S	Bend	trans	-87	-3.4	-178.3	64.1	31.4	0	0	0	114.4	S342 S343 R348	S342-D346 PolarHBondContact O-N 2.71Å; S342-D346 VanDerWaalsContact O-OD2 3.06Å; S343-D346 VanDerWaalsContact CA-OD1 3.28Å; S343-D346 WeakPolarHBondContact CA-OD1 3.28Å; S343-D346 VanDerWaalsContact O-OD1 3.06Å; D346-R348 VanDerWaalsContact C-N 3.32Å; D346-R348 PolarHBondContact O-N 3.27Å; D346-R348 WeakPolarHBondContact OD1-CB 3.5Å; D346-R348 WeakPolarHBondContact OD1-CG 3.12Å; D346-R348 PolarHBondContact OD1-N 3.38Å; D346-R348 IonicContact OD1-NE 2.67Å; D346-R348 PolarHBondContact OD1-NE 2.95Å; D346-R348 IonicContact OD2-CZ 2.85Å; D346-R348 IonicContact OD2-NE 3.14Å; D346-R348 PolarHBondContact OD2-NE 3.07Å; D346-R348 IonicContact OD2-NH2 2.78Å; D346-R348 PolarHBondContact OD2-NH2 3.44Å
347	G	76.9	Confident	86.5	Confident	44 Å²	44	54 Å²	54	45%	0.454	26%	0.26	S	S	.	.	S	Bend	trans	82.2	-3	178.6	0	0	0	0	0	115.5	S343 I344 F349 R350	S343-G347 CarbonylContact O-C 3.58Å; S343-G347 PolarHBondContact O-N 2.78Å; I344-G347 PolarHBondContact O-N 3Å; G347-F349 PolarHBondContact O-N 3.48Å; G347-R350 PolarHBondContact O-N 3.47Å
348	R	82.8	Confident	86.5	Confident	126 Å²	126	60.1 Å²	60.1	48%	0.475	28%	0.282	S	S	.	.	H	α-helix	trans	-62.8	-28.8	178.5	-70.8	-175.4	-70.1	171.8	-3.4	113	S343 D346 R350 E351 Q352	S343-R348 PolarHBondContact O-N 3.4Å; S343-R348 VanDerWaalsContact O-N 3.09Å; D346-R348 VanDerWaalsContact C-N 3.32Å; D346-R348 PolarHBondContact O-N 3.27Å; D346-R348 WeakPolarHBondContact OD1-CB 3.5Å; D346-R348 WeakPolarHBondContact OD1-CG 3.12Å; D346-R348 PolarHBondContact OD1-N 3.38Å; D346-R348 IonicContact OD1-NE 2.67Å; D346-R348 PolarHBondContact OD1-NE 2.95Å; D346-R348 IonicContact OD2-CZ 2.85Å; D346-R348 IonicContact OD2-NE 3.14Å; D346-R348 PolarHBondContact OD2-NE 3.07Å; D346-R348 IonicContact OD2-NH2 2.78Å; D346-R348 PolarHBondContact OD2-NH2 3.44Å; R348-R350 VanDerWaalsContact C-N 3.27Å; R348-R350 PolarHBondContact O-N 3.35Å; R348-E351 PolarHBondContact O-N 3.21Å; R348-E351 VanDerWaalsContact O-N 3.13Å; R348-Q352 WeakPolarHBondContact O-CB 3.38Å; R348-Q352 VanDerWaalsContact O-CG 3.31Å; R348-Q352 WeakPolarHBondContact O-CG 3.3Å; R348-Q352 PolarHBondContact O-N 3.3Å
349	F	88	Confident	86.6	Confident	18 Å²	18	57.7 Å²	57.7	8%	0.079	27%	0.269	C	S	.	.	H	α-helix	trans	-55	-39.5	-178.9	173.4	-118.2	0	0	0	113.4	L340 S343 I344 G347 K353 A387 T391	L340-F349 HydrophobicContact CD1-CD2 3.67Å; L340-F349 HydrophobicContact CD1-CE2 3.63Å; L340-F349 HydrophobicContact CD1-CG 4.47Å; L340-F349 HydrophobicContact CD1-CZ 4.38Å; S343-F349 VanDerWaalsContact O-CB 3.29Å; S343-F349 WeakPolarHBondContact O-CB 3.44Å; S343-F349 PolarHBondContact O-N 3.26Å; I344-F349 HydrophobicContact CG1-CB 4.07Å; I344-F349 HydrophobicContact CG1-CD1 3.92Å; I344-F349 HydrophobicContact CG1-CE1 4.48Å; I344-F349 HydrophobicContact CG1-CG 3.96Å; G347-F349 PolarHBondContact O-N 3.48Å; F349-K353 VanDerWaalsContact CE1-NZ 3.29Å; F349-K353 HydrophobicContact CE2-CD 3.96Å; F349-K353 HydrophobicContact CZ-CD 4.06Å; F349-K353 VanDerWaalsContact CZ-CE 3.41Å; F349-K353 WeakPolarHBondContact O-CG 3.47Å; F349-K353 PolarHBondContact O-N 3.3Å; F349-A387 HydrophobicContact CE1-CB 4.09Å; F349-A387 HydrophobicContact CZ-CB 4.04Å; F349-T391 WeakPolarHBondContact CZ-OG1 3.45Å
350	R	84.9	Confident	86.5	Confident	205 Å²	205	56.5 Å²	56.5	77%	0.774	27%	0.27	S	S	*	.	H	α-helix	trans	-75.6	-39.5	178.5	-67.8	-177.8	177.7	-177.4	-0.7	112	G347 R348 F354	G347-R350 PolarHBondContact O-N 3.47Å; R348-R350 VanDerWaalsContact C-N 3.27Å; R348-R350 PolarHBondContact O-N 3.35Å; R350-F354 WeakPolarHBondContact O-CB 3.39Å; R350-F354 PolarHBondContact O-N 3.31Å
351	E	85.4	Confident	86.6	Confident	71 Å²	71	56.6 Å²	56.6	33%	0.332	27%	0.27	S	S	.	.	H	α-helix	trans	-64.2	-44.2	178.6	-179.9	-91.6	-176.4	0	0	111.7	R348 K353 F354 R355	R348-E351 PolarHBondContact O-N 3.21Å; R348-E351 VanDerWaalsContact O-N 3.13Å; E351-K353 PolarHBondContact O-N 3.32Å; E351-F354 WeakPolarHBondContact O-CB 3.22Å; E351-F354 PolarHBondContact O-N 3.09Å; E351-R355 WeakPolarHBondContact O-CG 3.48Å; E351-R355 PolarHBondContact O-N 3.26Å; E351-R355 WeakPolarHBondContact OE1-CD 3.34Å; E351-R355 IonicContact OE1-NE 3.47Å
352	Q	87.9	Confident	86.7	Confident	33 Å²	33	60.7 Å²	60.7	15%	0.154	29%	0.289	C	S	.	.	H	α-helix	trans	-59.7	-50.2	179	-73.3	171.2	-21	0	0	111.2	R348 F354 R355 L356	R348-Q352 WeakPolarHBondContact O-CB 3.38Å; R348-Q352 VanDerWaalsContact O-CG 3.31Å; R348-Q352 WeakPolarHBondContact O-CG 3.3Å; R348-Q352 PolarHBondContact O-N 3.3Å; Q352-F354 VanDerWaalsContact C-N 3.32Å; Q352-F354 PolarHBondContact O-N 2.96Å; Q352-R355 PolarHBondContact O-N 2.91Å; Q352-R355 VanDerWaalsContact O-N 3.15Å; Q352-L356 WeakPolarHBondContact O-CG 3.37Å; Q352-L356 PolarHBondContact O-N 3.38Å
353	K	89.9	Confident	87	Confident	12 Å²	12	63 Å²	63	5%	0.052	29%	0.29	C	S	.	.	H	α-helix	trans	-61.9	-38.7	175.9	-68.5	-167.8	-66	177.9	0	112.7	F349 E351 R355 L356 K357 Y366 T391 D395 F397	F349-K353 VanDerWaalsContact CE1-NZ 3.29Å; F349-K353 HydrophobicContact CE2-CD 3.96Å; F349-K353 HydrophobicContact CZ-CD 4.06Å; F349-K353 VanDerWaalsContact CZ-CE 3.41Å; F349-K353 WeakPolarHBondContact O-CG 3.47Å; F349-K353 PolarHBondContact O-N 3.3Å; E351-K353 PolarHBondContact O-N 3.32Å; K353-R355 VanDerWaalsContact C-N 3.31Å; K353-R355 PolarHBondContact O-N 3.48Å; K353-L356 PolarHBondContact O-N 2.82Å; K353-K357 WeakPolarHBondContact O-CG 3.49Å; K353-K357 PolarHBondContact O-N 3.43Å; K353-Y366 HydrophobicContact CG-CE2 4.5Å; K353-T391 HydrophobicContact CD-CG2 3.78Å; K353-T391 PolarHBondContact NZ-OG1 3.19Å; K353-D395 WeakPolarHBondContact CE-OD2 3.48Å; K353-D395 IonicContact NZ-OD2 2.92Å; K353-D395 PolarHBondContact NZ-OD2 3.11Å; K353-F397 HydrophobicContact CB-CE2 4.3Å; K353-F397 HydrophobicContact CB-CZ 4.28Å; K353-F397 HydrophobicContact CD-CE2 4.4Å; K353-F397 HydrophobicContact CG-CE2 4Å; K353-F397 HydrophobicContact CG-CZ 4.47Å
354	F	87.4	Confident	87.4	Confident	116 Å²	116	65.8 Å²	65.8	51%	0.509	30%	0.3	S	S	.	.	H	α-helix	trans	-61.5	-41	175.6	-179.8	-99	0	0	0	111.9	R350 E351 Q352 K357 R358	R350-F354 WeakPolarHBondContact O-CB 3.39Å; R350-F354 PolarHBondContact O-N 3.31Å; E351-F354 WeakPolarHBondContact O-CB 3.22Å; E351-F354 PolarHBondContact O-N 3.09Å; Q352-F354 VanDerWaalsContact C-N 3.32Å; Q352-F354 PolarHBondContact O-N 2.96Å; F354-K357 PolarHBondContact O-N 3.15Å; F354-R358 VanDerWaalsContact CZ-CD 3.41Å; F354-R358 PolarHBondContact O-N 3.17Å
355	R	88.3	Confident	88	Confident	46 Å²	46	64 Å²	64	17%	0.174	29%	0.291	C	S	.	.	H	α-helix	trans	-66	-43	176.2	-70.1	179.2	64.9	-134.1	2.6	112.2	H304 V305 E351 Q352 K353 K357 R358 C359 A463 K465	H304-R355 PolarHBondContact O-NH1 3.44Å; H304-R355 PolarHBondContact O-NH2 3.43Å; V305-R355 HydrophobicContact CG2-CB 4.07Å; E351-R355 WeakPolarHBondContact O-CG 3.48Å; E351-R355 PolarHBondContact O-N 3.26Å; E351-R355 WeakPolarHBondContact OE1-CD 3.34Å; E351-R355 IonicContact OE1-NE 3.47Å; Q352-R355 PolarHBondContact O-N 2.91Å; Q352-R355 VanDerWaalsContact O-N 3.15Å; K353-R355 VanDerWaalsContact C-N 3.31Å; K353-R355 PolarHBondContact O-N 3.48Å; R355-K357 VanDerWaalsContact C-N 3.3Å; R355-K357 PolarHBondContact O-N 2.9Å; R355-R358 CarbonylContact O-C 3.52Å; R355-R358 PolarHBondContact O-N 3.08Å; R355-R358 VanDerWaalsContact O-N 3.12Å; R355-C359 PolarHBondContact O-N 2.67Å; R355-A463 PolarHBondContact NH2-O 3.28Å; R355-K465 VanDerWaalsContact CZ-CG 3.5Å
356	L	92	Very high	88.7	Confident	3 Å²	3	60.1 Å²	60.1	2%	0.016	27%	0.271	C	S	.	.	H	α-helix	trans	-60.2	-37.9	174.6	-71.4	163.1	0	0	0	112.2	V305 I331 E333 Q352 K353 R358 C359 F397	V305-L356 HydrophobicContact CG2-CD2 3.93Å; V305-L356 HydrophobicContact CG2-CG 4.22Å; I331-L356 HydrophobicContact CD1-CD2 3.6Å; I331-L356 HydrophobicContact CG1-CD2 3.94Å; I331-L356 HydrophobicContact CG2-CD2 4.41Å; E333-L356 HydrophobicContact CB-CD1 3.72Å; E333-L356 HydrophobicContact CG-CD1 4.1Å; Q352-L356 WeakPolarHBondContact O-CG 3.37Å; Q352-L356 PolarHBondContact O-N 3.38Å; K353-L356 PolarHBondContact O-N 2.82Å; L356-R358 VanDerWaalsContact C-N 3.26Å; L356-R358 PolarHBondContact O-N 3.48Å; L356-C359 PolarHBondContact O-SG 3.34Å; L356-F397 HydrophobicContact CB-CE2 4.1Å; L356-F397 HydrophobicContact CB-CZ 3.83Å; L356-F397 HydrophobicContact CD1-CE2 3.81Å; L356-F397 HydrophobicContact CD1-CZ 4.4Å
357	K	89.3	Confident	89.5	Confident	76 Å²	76	56.6 Å²	56.6	33%	0.33	25%	0.252	S	S	.	.	H	α-helix	trans	-64.8	-29.2	176.3	-73.9	-178.2	-175.5	-171.3	0	113.4	K353 F354 R355 R364 D395 F397	K353-K357 WeakPolarHBondContact O-CG 3.49Å; K353-K357 PolarHBondContact O-N 3.43Å; F354-K357 PolarHBondContact O-N 3.15Å; R355-K357 VanDerWaalsContact C-N 3.3Å; R355-K357 PolarHBondContact O-N 2.9Å; K357-R364 PolarHBondContact O-NH2 3.04Å; K357-D395 VanDerWaalsContact CE-OD1 3.26Å; K357-D395 WeakPolarHBondContact CE-OD1 3.47Å; K357-D395 IonicContact NZ-OD1 3.21Å; K357-D395 PolarHBondContact NZ-OD1 3.5Å; K357-F397 HydrophobicContact CG-CE1 3.79Å; K357-F397 HydrophobicContact CG-CZ 4.02Å
358	R	86.8	Confident	90.4	Very high	148 Å²	148	54.7 Å²	54.7	56%	0.558	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-108.7	16.9	-173.9	-59.5	-174	75.6	-173.8	5.1	113.9	F354 R355 L356	F354-R358 VanDerWaalsContact CZ-CD 3.41Å; F354-R358 PolarHBondContact O-N 3.17Å; R355-R358 CarbonylContact O-C 3.52Å; R355-R358 PolarHBondContact O-N 3.08Å; R355-R358 VanDerWaalsContact O-N 3.12Å; L356-R358 VanDerWaalsContact C-N 3.26Å; L356-R358 PolarHBondContact O-N 3.48Å
359	C	87.9	Confident	90.8	Very high	2 Å²	2	48.7 Å²	48.7	1%	0.014	21%	0.209	C	C	.	.	S	Bend	trans	-88.7	-0.9	-179.9	73.7	0	0	0	0	114.4	V305 R355 L356 L361 W433 F459	V305-C359 HydrophobicContact CG1-CB 3.63Å; V305-C359 HydrophobicContact CG2-CB 4.34Å; R355-C359 PolarHBondContact O-N 2.67Å; L356-C359 PolarHBondContact O-SG 3.34Å; C359-L361 VanDerWaalsContact C-N 3.31Å; C359-L361 PolarHBondContact O-N 3.33Å; C359-W433 VanDerWaalsContact O-CH2 3.25Å; C359-W433 WeakPolarHBondContact O-CH2 3.49Å; C359-F459 HydrophobicContact CB-CE2 4.01Å; C359-F459 WeakPolarHBondContact O-CD2 3.26Å
360	G	87.6	Confident	90.6	Very high	29 Å²	29	52.2 Å²	52.2	30%	0.299	23%	0.226	S	C	.	.	S	Bend	trans	83.6	-0.3	178.8	0	0	0	0	0	115.3	R431	G360-R431 PolarHBondContact O-NH2 2.94Å
361	L	91.6	Very high	89.7	Confident	2 Å²	2	45.4 Å²	45.4	1%	0.01	20%	0.203	C	C	.	.			trans	-105.8	128.6	173.2	-52.2	-177.6	0	0	0	109.9	V309 V327 I331 C359 R364 L454 F459	V309-L361 HydrophobicContact CG1-CD1 4.18Å; V327-L361 HydrophobicContact CG1-CD2 4.01Å; V327-L361 HydrophobicContact CG2-CD1 4Å; V327-L361 HydrophobicContact CG2-CD2 4.33Å; I331-L361 HydrophobicContact CB-CB 4.38Å; I331-L361 HydrophobicContact CB-CD1 3.85Å; I331-L361 HydrophobicContact CD1-CD1 4.25Å; I331-L361 HydrophobicContact CG2-CB 4.05Å; I331-L361 HydrophobicContact CG2-CD1 4.43Å; C359-L361 VanDerWaalsContact C-N 3.31Å; C359-L361 PolarHBondContact O-N 3.33Å; L361-R364 VanDerWaalsContact O-CD 3.3Å; L361-R364 WeakPolarHBondContact O-CD 3.45Å; L361-R364 PolarHBondContact O-NE 2.91Å; L361-L454 HydrophobicContact CD2-CD1 4.42Å; L361-F459 HydrophobicContact CD1-CD2 3.95Å; L361-F459 HydrophobicContact CD1-CE2 3.46Å; L361-F459 VanDerWaalsContact CD1-CE2 3.46Å; L361-F459 HydrophobicContact CD1-CZ 3.93Å; L361-F459 HydrophobicContact CD2-CD2 4.44Å; L361-F459 HydrophobicContact CG-CD2 4.04Å; L361-F459 HydrophobicContact CG-CE2 3.84Å
362	E	90.5	Very high	88.5	Confident	87 Å²	87	44.9 Å²	44.9	41%	0.407	22%	0.217	S	C	.	.			trans	-93.9	-28.6	-170.9	-60.9	-169.6	165.2	0	0	113.6	D329 R364 S446	D329-E362 PolarHBondContact OD1-N 3.48Å; E362-R364 VanDerWaalsContact C-CD 3.43Å; E362-R364 WeakPolarHBondContact O-CD 3.46Å; E362-R364 PolarHBondContact O-N 3.47Å; E362-R364 VanDerWaalsContact O-N 3.14Å; E362-R364 PolarHBondContact O-NH1 2.98Å; E362-S446 PolarHBondContact OE2-OG 3.4Å
363	R	93.9	Very high	87	Confident	101 Å²	101	47 Å²	47	38%	0.381	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	78.6	178	-55.5	-65.7	179.8	170.5	-0.5	110.6	D329 H330 I331	D329-R363 HydrophobicContact CB-CG 4.45Å; D329-R363 WeakPolarHBondContact O-CA 3.49Å; D329-R363 VanDerWaalsContact O-CB 3.29Å; D329-R363 WeakPolarHBondContact O-CB 3.4Å; D329-R363 PolarHBondContact O-N 3.09Å; D329-R363 WeakPolarHBondContact OD2-CG 3.4Å; H330-R363 WeakPolarHBondContact CA-O 2.99Å; H330-R363 HydrophobicContact CB-CB 4.46Å; I331-R363 PolarHBondContact N-O 2.88Å
364	R	96.3	Very high	85.6	Confident	60 Å²	60	48.6 Å²	48.6	23%	0.226	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	124.8	177.8	-60	72.9	156.9	-150.5	2.1	110.4	I331 K357 L361 E362 F397 F398	I331-R364 HydrophobicContact CG2-CB 4.31Å; I331-R364 HydrophobicContact CG2-CG 3.99Å; K357-R364 PolarHBondContact O-NH2 3.04Å; L361-R364 VanDerWaalsContact O-CD 3.3Å; L361-R364 WeakPolarHBondContact O-CD 3.45Å; L361-R364 PolarHBondContact O-NE 2.91Å; E362-R364 VanDerWaalsContact C-CD 3.43Å; E362-R364 WeakPolarHBondContact O-CD 3.46Å; E362-R364 PolarHBondContact O-N 3.47Å; E362-R364 VanDerWaalsContact O-N 3.14Å; E362-R364 PolarHBondContact O-NH1 2.98Å; R364-F397 HydrophobicContact CB-CB 4.43Å; R364-F397 HydrophobicContact CB-CD1 3.67Å; R364-F397 HydrophobicContact CB-CD2 4.06Å; R364-F397 HydrophobicContact CB-CE1 3.85Å; R364-F397 HydrophobicContact CB-CE2 4.21Å; R364-F397 HydrophobicContact CB-CG 3.8Å; R364-F397 HydrophobicContact CB-CZ 4.12Å; R364-F397 HydrophobicContact CG-CD1 4.14Å; R364-F397 HydrophobicContact CG-CE1 3.82Å; R364-F397 HydrophobicContact CG-CZ 4.04Å; R364-F398 PolarHBondContact O-N 3.36Å
365	V	97.9	Very high	84.2	Confident	9 Å²	9	50.8 Å²	50.8	6%	0.055	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	133	174.5	178.5	0	0	0	0	109.1	I331 V332 E333 F398 Y411	I331-V365 PolarHBondContact O-N 3.32Å; V332-V365 WeakPolarHBondContact CA-O 3.28Å; V332-V365 HydrophobicContact CB-CB 4.37Å; V332-V365 HydrophobicContact CG1-CB 4.38Å; V332-V365 HydrophobicContact CG1-CG1 4.18Å; V332-V365 HydrophobicContact CG2-CB 3.97Å; V332-V365 HydrophobicContact CG2-CG1 4.26Å; E333-V365 PolarHBondContact N-O 3.08Å; V365-F398 CarbonylContact C-O 3.32Å; V365-F398 VanDerWaalsContact CA-O 3.27Å; V365-F398 WeakPolarHBondContact CA-O 3.12Å; V365-F398 HydrophobicContact CG1-CD1 4.21Å; V365-F398 HydrophobicContact CG2-CB 4.32Å; V365-F398 HydrophobicContact CG2-CD1 4.41Å; V365-Y411 HydrophobicContact CG1-CE1 4.11Å
366	Y	97.8	Very high	83.1	Confident	1 Å²	1	55.6 Å²	55.6	0%	0.004	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	105.2	173.9	-154.9	-91	0	0	0	108.5	E333 K335 K353 V368 T391 F397 F398 V399 K400	E333-Y366 HydrophobicContact CB-CD2 4.09Å; E333-Y366 HydrophobicContact CB-CE2 4.26Å; E333-Y366 HydrophobicContact CG-CD2 4.3Å; E333-Y366 HydrophobicContact CG-CE2 3.95Å; K335-Y366 HydrophobicContact CB-CE1 3.79Å; K335-Y366 HydrophobicContact CG-CE1 4.39Å; K335-Y366 WeakPolarHBondContact CG-OH 3.46Å; K353-Y366 HydrophobicContact CG-CE2 4.5Å; Y366-V368 HydrophobicContact CD1-CG2 3.61Å; Y366-V368 HydrophobicContact CE1-CG2 3.92Å; Y366-T391 HydrophobicContact CD1-CG2 4.39Å; Y366-T391 HydrophobicContact CD2-CG2 4.02Å; Y366-T391 HydrophobicContact CG-CG2 3.91Å; Y366-F397 HydrophobicContact CD2-CD2 4.07Å; Y366-F397 HydrophobicContact CD2-CE2 4.46Å; Y366-F398 PolarHBondContact N-O 3.48Å; Y366-V399 WeakPolarHBondContact O-CA 3.43Å; Y366-K400 PolarHBondContact O-N 3.29Å
367	L	97.3	Very high	82.2	Confident	0 Å²	0	57.3 Å²	57.3	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	103	-176.6	179.6	63.1	0	0	0	109.4	V332 E333 R334 K335 K400 T402 Y411	V332-L367 HydrophobicContact CG1-CB 3.75Å; V332-L367 HydrophobicContact CG1-CD2 4.38Å; E333-L367 PolarHBondContact O-N 3.44Å; R334-L367 CarbonylContact C-O 3.45Å; R334-L367 WeakPolarHBondContact CA-O 3.46Å; R334-L367 HydrophobicContact CB-CB 4.41Å; R334-L367 HydrophobicContact CB-CD2 4.38Å; R334-L367 HydrophobicContact CG-CD2 4.33Å; K335-L367 PolarHBondContact N-O 3.05Å; L367-K400 CarbonylContact C-O 3.54Å; L367-K400 WeakPolarHBondContact CA-O 3.4Å; L367-K400 HydrophobicContact CD1-CB 3.88Å; L367-K400 HydrophobicContact CD1-CG 3.64Å; L367-T402 HydrophobicContact CD1-CG2 3.63Å; L367-Y411 HydrophobicContact CD1-CD1 3.96Å; L367-Y411 HydrophobicContact CD1-CE1 4.39Å; L367-Y411 HydrophobicContact CD2-CD1 4.42Å
368	V	95.1	Very high	81.7	Confident	3 Å²	3	56.3 Å²	56.3	2%	0.018	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	117.3	-179.1	-175.1	0	0	0	0	109.3	K335 L337 Y366 V388 V399 K400 R401 T402	K335-V368 WeakPolarHBondContact O-CA 3.41Å; L337-V368 HydrophobicContact CD1-CG1 4.43Å; Y366-V368 HydrophobicContact CD1-CG2 3.61Å; Y366-V368 HydrophobicContact CE1-CG2 3.92Å; V368-V388 HydrophobicContact CG1-CG2 4.44Å; V368-V388 HydrophobicContact CG2-CG1 4.22Å; V368-V388 HydrophobicContact CG2-CG2 4.04Å; V368-V399 HydrophobicContact CG2-CG1 4.27Å; V368-K400 PolarHBondContact N-O 2.98Å; V368-R401 HydrophobicContact CB-CG 4.38Å; V368-R401 CarbonylContact O-C 3.59Å; V368-R401 WeakPolarHBondContact O-CA 3.49Å; V368-T402 PolarHBondContact O-N 3.29Å; V368-T402 PolarHBondContact O-OG1 3.11Å
369	E	91.1	Very high	81.5	Confident	1 Å²	1	50.6 Å²	50.6	1%	0.005	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	123.7	-178.8	-169.1	-178.3	97.8	0	0	111.1	R334 K335 R336 L337 H371 T402 I405 S408	R334-E369 IonicContact CZ-OE1 2.66Å; R334-E369 IonicContact CZ-OE2 3.39Å; R334-E369 VanDerWaalsContact CZ-OE2 3.29Å; R334-E369 IonicContact NE-OE1 3.34Å; R334-E369 IonicContact NE-OE2 2.78Å; R334-E369 PolarHBondContact NE-OE2 3.29Å; R334-E369 IonicContact NH2-OE1 3.74Å; R334-E369 PolarHBondContact NH2-OE1 2.86Å; R334-E369 IonicContact NH2-OE2 3.11Å; R334-E369 PolarHBondContact NH2-OE2 3.01Å; K335-E369 PolarHBondContact O-N 3.28Å; R336-E369 WeakPolarHBondContact CA-O 3.45Å; R336-E369 HydrophobicContact CG-CB 4.42Å; L337-E369 PolarHBondContact N-O 3.17Å; E369-H371 PolarHBondContact O-N 3.45Å; E369-T402 WeakPolarHBondContact CA-O 3.48Å; E369-I405 WeakPolarHBondContact OE2-CA 3.48Å; E369-S408 WeakPolarHBondContact OE2-CB 3.34Å; E369-S408 PolarHBondContact OE2-OG 3.14Å
370	E	83.8	Confident	81.4	Confident	91 Å²	91	53.2 Å²	53.2	43%	0.425	30%	0.295	S	S	.	.			trans	-89.1	68.8	-176.7	-66.1	-177.9	-169.6	0	0	111.6	G372 T402 A403	E370-G372 PolarHBondContact O-N 2.65Å; E370-T402 PolarHBondContact N-O 3.44Å; E370-A403 CarbonylContact C-O 3.49Å
371	H	65.7	Low	81.3	Confident	63 Å²	63	57.8 Å²	57.8	29%	0.292	31%	0.309	S	S	.	.			trans	-82.5	104.2	-179.8	-157.9	84.1	0	0	0	112.5	H283 E369	H283-H371 AromaticContact CD2-CE1 3.87Å; H283-H371 AromaticContact CD2-NE2 3.57Å; H283-H371 AromaticContact NE2-CE1 3.78Å; H283-H371 AromaticContact NE2-NE2 3.38Å; H283-H371 PolarHBondContact NE2-NE2 3.24Å; E369-H371 PolarHBondContact O-N 3.45Å
372	G	60.8	Low	81.1	Confident	60 Å²	60	61.8 Å²	61.8	62%	0.619	34%	0.336	S	S	*	.	S	Bend	trans	90.5	-173.1	169.6	0	0	0	0	0	115.5	E370 V374	E370-G372 PolarHBondContact O-N 2.65Å; G372-V374 PolarHBondContact O-N 3.47Å
373	S	56.5	Low	81.1	Confident	77 Å²	77	60.1 Å²	60.1	54%	0.538	33%	0.332	S	S	.	.			trans	-71.7	116.9	-173.8	-168.8	0	0	0	0	111.9	H375 N376	S373-H375 PolarHBondContact O-N 3.42Å; S373-H375 PolarHBondContact OG-CD2 2.92Å; S373-N376 PolarHBondContact O-N 3.12Å
374	V	60.5	Low	80.9	Confident	45 Å²	45	55.5 Å²	55.5	27%	0.273	32%	0.315	S	S	.	.	G	3₁₀ helix	trans	-52.7	-22.3	177.4	-174.3	0	0	0	0	112.6	L337 G372 N376 L377 E381	L337-V374 HydrophobicContact CD2-CG1 4.48Å; L337-V374 HydrophobicContact CD2-CG2 4.27Å; G372-V374 PolarHBondContact O-N 3.47Å; V374-N376 VanDerWaalsContact C-N 3.3Å; V374-N376 PolarHBondContact O-N 3.22Å; V374-L377 HydrophobicContact CG1-CD1 4.19Å; V374-L377 WeakPolarHBondContact O-CG 3.4Å; V374-E381 HydrophobicContact CG1-CB 4.22Å; V374-E381 HydrophobicContact CG1-CG 4.02Å
375	H	57.4	Low	80.7	Confident	163 Å²	163	56.6 Å²	56.6	76%	0.755	33%	0.325	S	S	*	.	G	3₁₀ helix	trans	-73.8	-9.2	-175	-59.2	-61.3	0	0	0	115.6	S373	S373-H375 PolarHBondContact O-N 3.42Å; S373-H375 PolarHBondContact OG-CD2 2.92Å
376	N	64.6	Low	80.4	Confident	146 Å²	146	61.1 Å²	61.1	78%	0.781	35%	0.346	S	S	*	.	G	3₁₀ helix	trans	-104	11.7	179.2	-71.1	-29.6	0	0	0	114.2	S373 V374	S373-N376 PolarHBondContact O-N 3.12Å; V374-N376 VanDerWaalsContact C-N 3.3Å; V374-N376 PolarHBondContact O-N 3.22Å
377	L	74.6	Confident	80.2	Confident	40 Å²	40	61.5 Å²	61.5	21%	0.209	35%	0.349	C	S	.	.			trans	-84	146.3	-176.3	-62.4	175.4	0	0	0	112.1	L337 D338 V374 L379 L384	L337-L377 HydrophobicContact CB-CD1 4.41Å; L337-L377 HydrophobicContact CD2-CD1 3.55Å; L337-L377 HydrophobicContact CG-CD1 3.63Å; D338-L377 HydrophobicContact CB-CD2 4.06Å; V374-L377 HydrophobicContact CG1-CD1 4.19Å; V374-L377 WeakPolarHBondContact O-CG 3.4Å; L377-L379 PolarHBondContact O-N 3.35Å; L377-L384 HydrophobicContact CD1-CD1 3.59Å
378	S	78.2	Confident	80	Confident	54 Å²	54	61.8 Å²	61.8	38%	0.378	35%	0.351	S	S	.	.	S	Bend	trans	-72.5	-8.1	-179.1	-46.1	0	0	0	0	114
379	L	81.6	Confident	80	Confident	28 Å²	28	64 Å²	64	15%	0.147	36%	0.364	C	S	.	.	S	Bend	trans	-124.1	147.6	178.8	-68	179.9	0	0	0	110.7	C341 I344 I345 L377 T383 L384	C341-L379 HydrophobicContact CB-CD1 4.43Å; I344-L379 HydrophobicContact CB-CD1 3.77Å; I344-L379 HydrophobicContact CD1-CD1 4.06Å; I344-L379 HydrophobicContact CG2-CD1 3.67Å; I345-L379 HydrophobicContact CD1-CD2 4.29Å; I345-L379 HydrophobicContact CD1-CG 4.17Å; I345-L379 HydrophobicContact CG1-CD1 4.23Å; I345-L379 HydrophobicContact CG1-CD2 4.07Å; I345-L379 HydrophobicContact CG1-CG 4.19Å; L377-L379 PolarHBondContact O-N 3.35Å; L379-T383 HydrophobicContact CD1-CG2 4.41Å; L379-L384 HydrophobicContact CB-CD2 4.43Å; L379-L384 HydrophobicContact CB-CG 4.46Å; L379-L384 HydrophobicContact CD1-CD2 4.32Å
380	P	86.4	Confident	80.2	Confident	58 Å²	58	66.4 Å²	66.4	38%	0.377	38%	0.377	S	S	.	.			trans	-59.7	143.1	172.7	-20.6	31.8	0	0	0	111.6	S382 T383 L384	P380-S382 PolarHBondContact O-N 3.07Å; P380-T383 WeakPolarHBondContact O-CA 3.15Å; P380-T383 VanDerWaalsContact O-CB 3.29Å; P380-T383 WeakPolarHBondContact O-CB 3.25Å; P380-T383 PolarHBondContact O-N 3.1Å; P380-L384 PolarHBondContact O-N 3.05Å
381	E	85.6	Confident	80.7	Confident	125 Å²	125	62 Å²	62	58%	0.584	36%	0.357	S	S	*	.	H	α-helix	trans	-54.1	-40.6	177.8	-173.4	-174.8	163.5	0	0	112.3	V374 T383 L384 L385	V374-E381 HydrophobicContact CG1-CB 4.22Å; V374-E381 HydrophobicContact CG1-CG 4.02Å; E381-T383 PolarHBondContact O-N 3.38Å; E381-L384 WeakPolarHBondContact O-CB 3.35Å; E381-L384 PolarHBondContact O-N 2.86Å; E381-L385 WeakPolarHBondContact O-CB 3.4Å; E381-L385 PolarHBondContact O-N 3.12Å
382	S	88.3	Confident	82.1	Confident	85 Å²	85	63.9 Å²	63.9	59%	0.594	37%	0.366	S	S	*	.	H	α-helix	trans	-57.9	-33.1	176.1	59.6	0	0	0	0	113.2	P380 Q386	P380-S382 PolarHBondContact O-N 3.07Å; S382-Q386 VanDerWaalsContact O-CB 3.3Å; S382-Q386 WeakPolarHBondContact O-CB 3.47Å; S382-Q386 PolarHBondContact O-N 3.2Å
383	T	90.1	Very high	83.7	Confident	52 Å²	52	66.2 Å²	66.2	32%	0.319	37%	0.368	S	S	.	.	H	α-helix	trans	-71.8	-39.4	176.6	-60	0	0	0	0	111	L379 P380 E381 Q386 A387	L379-T383 HydrophobicContact CD1-CG2 4.41Å; P380-T383 WeakPolarHBondContact O-CA 3.15Å; P380-T383 VanDerWaalsContact O-CB 3.29Å; P380-T383 WeakPolarHBondContact O-CB 3.25Å; P380-T383 PolarHBondContact O-N 3.1Å; E381-T383 PolarHBondContact O-N 3.38Å; T383-Q386 PolarHBondContact O-N 2.91Å; T383-A387 WeakPolarHBondContact O-CB 3.46Å; T383-A387 PolarHBondContact O-N 3.34Å
384	L	90.2	Very high	85.4	Confident	5 Å²	5	68.2 Å²	68.2	3%	0.026	37%	0.371	C	S	.	.	H	α-helix	trans	-68.2	-46.4	176.9	-62.1	169.8	0	0	0	110.9	L337 L340 C341 I344 L377 L379 P380 E381 Q386 A387 V388	L337-L384 HydrophobicContact CD1-CB 4.33Å; L337-L384 HydrophobicContact CD1-CD1 3.98Å; L337-L384 HydrophobicContact CD2-CD1 4.45Å; L337-L384 HydrophobicContact CG-CD1 4.04Å; L340-L384 HydrophobicContact CD2-CD2 4.09Å; L340-L384 HydrophobicContact CG-CD2 4.07Å; C341-L384 VanDerWaalsContact SG-CD1 3.58Å; C341-L384 WeakPolarHBondContact SG-CD2 3.48Å; I344-L384 HydrophobicContact CD1-CD2 3.97Å; L377-L384 HydrophobicContact CD1-CD1 3.59Å; L379-L384 HydrophobicContact CB-CD2 4.43Å; L379-L384 HydrophobicContact CB-CG 4.46Å; L379-L384 HydrophobicContact CD1-CD2 4.32Å; P380-L384 PolarHBondContact O-N 3.05Å; E381-L384 WeakPolarHBondContact O-CB 3.35Å; E381-L384 PolarHBondContact O-N 2.86Å; L384-Q386 VanDerWaalsContact C-N 3.32Å; L384-Q386 PolarHBondContact O-N 3.22Å; L384-A387 WeakPolarHBondContact O-CB 3.29Å; L384-A387 PolarHBondContact O-N 3.46Å; L384-A387 VanDerWaalsContact O-N 3.09Å; L384-V388 WeakPolarHBondContact O-CG2 3.49Å; L384-V388 PolarHBondContact O-N 3.46Å
385	L	90.8	Very high	86.7	Confident	82 Å²	82	67.7 Å²	67.7	43%	0.429	37%	0.367	S	S	.	.	H	α-helix	trans	-56.4	-47.8	174.4	-178.6	60.6	0	0	0	110.7	E381 A387 V388 T389	E381-L385 WeakPolarHBondContact O-CB 3.4Å; E381-L385 PolarHBondContact O-N 3.12Å; L385-A387 VanDerWaalsContact C-N 3.33Å; L385-A387 PolarHBondContact O-N 3.38Å; L385-V388 PolarHBondContact O-N 3.2Å; L385-T389 WeakPolarHBondContact O-CB 3.48Å; L385-T389 PolarHBondContact O-N 3.35Å; L385-T389 PolarHBondContact O-OG1 3.19Å
386	Q	92.7	Very high	88.4	Confident	104 Å²	104	62.7 Å²	62.7	49%	0.486	36%	0.359	S	S	.	.	H	α-helix	trans	-61.1	-40.6	176	-171.8	66.3	56.4	0	0	112.2	S382 T383 L384 T389 N390	S382-Q386 VanDerWaalsContact O-CB 3.3Å; S382-Q386 WeakPolarHBondContact O-CB 3.47Å; S382-Q386 PolarHBondContact O-N 3.2Å; T383-Q386 PolarHBondContact O-N 2.91Å; L384-Q386 VanDerWaalsContact C-N 3.32Å; L384-Q386 PolarHBondContact O-N 3.22Å; Q386-T389 PolarHBondContact O-N 3.28Å; Q386-N390 PolarHBondContact NE2-OD1 2.9Å; Q386-N390 VanDerWaalsContact O-CB 3.27Å; Q386-N390 WeakPolarHBondContact O-CB 3.32Å; Q386-N390 PolarHBondContact O-N 3.45Å; Q386-N390 PolarHBondContact O-ND2 2.9Å; Q386-N390 PolarHBondContact O-OD1 3.49Å
387	A	92.6	Very high	90	Very high	10 Å²	10	55.9 Å²	55.9	8%	0.083	32%	0.323	C	S	.	.	H	α-helix	trans	-64.6	-41.1	178.5	0	0	0	0	0	112.3	I344 F349 T383 L384 L385 T391	I344-A387 HydrophobicContact CD1-CB 3.71Å; F349-A387 HydrophobicContact CE1-CB 4.09Å; F349-A387 HydrophobicContact CZ-CB 4.04Å; T383-A387 WeakPolarHBondContact O-CB 3.46Å; T383-A387 PolarHBondContact O-N 3.34Å; L384-A387 WeakPolarHBondContact O-CB 3.29Å; L384-A387 PolarHBondContact O-N 3.46Å; L384-A387 VanDerWaalsContact O-N 3.09Å; L385-A387 VanDerWaalsContact C-N 3.33Å; L385-A387 PolarHBondContact O-N 3.38Å; A387-T391 PolarHBondContact O-N 2.85Å; A387-T391 VanDerWaalsContact O-N 3.09Å; A387-T391 PolarHBondContact O-OG1 3.15Å
388	V	94.2	Very high	91.1	Very high	6 Å²	6	59.9 Å²	59.9	4%	0.036	34%	0.338	C	S	.	.	H	α-helix	trans	-66.8	-47.3	175.3	174.4	0	0	0	0	110.5	L340 V368 L384 L385 N390 T391 Q392 V399	L340-V388 HydrophobicContact CD2-CG2 3.87Å; V368-V388 HydrophobicContact CG1-CG2 4.44Å; V368-V388 HydrophobicContact CG2-CG1 4.22Å; V368-V388 HydrophobicContact CG2-CG2 4.04Å; L384-V388 WeakPolarHBondContact O-CG2 3.49Å; L384-V388 PolarHBondContact O-N 3.46Å; L385-V388 PolarHBondContact O-N 3.2Å; V388-N390 VanDerWaalsContact C-N 3.34Å; V388-N390 PolarHBondContact O-N 2.91Å; V388-T391 WeakPolarHBondContact O-CA 2.93Å; V388-T391 WeakPolarHBondContact O-CB 3.31Å; V388-T391 PolarHBondContact O-N 3.02Å; V388-Q392 PolarHBondContact O-N 2.98Å; V388-V399 HydrophobicContact CG1-CG1 3.56Å; V388-V399 HydrophobicContact CG1-CG2 4.39Å
389	T	94.9	Very high	92	Very high	48 Å²	48	58.2 Å²	58.2	29%	0.294	33%	0.326	S	S	.	.	H	α-helix	trans	-60.8	-41.7	176.9	-59.2	0	0	0	0	112	L385 Q386 T391 Q392 V393	L385-T389 WeakPolarHBondContact O-CB 3.48Å; L385-T389 PolarHBondContact O-N 3.35Å; L385-T389 PolarHBondContact O-OG1 3.19Å; Q386-T389 PolarHBondContact O-N 3.28Å; T389-T391 VanDerWaalsContact C-N 3.26Å; T389-T391 PolarHBondContact O-N 3.19Å; T389-Q392 PolarHBondContact O-N 3.5Å; T389-Q392 VanDerWaalsContact O-N 3.17Å; T389-V393 HydrophobicContact CG2-CG2 4.14Å; T389-V393 WeakPolarHBondContact O-CG2 3.33Å; T389-V393 PolarHBondContact O-N 3.33Å
390	N	93.8	Very high	92.7	Very high	52 Å²	52	60.5 Å²	60.5	28%	0.278	34%	0.335	S	S	.	.	H	α-helix	trans	-61.6	-36.8	174.2	-73.6	-11.7	0	0	0	111.7	Q386 V388 Q392 I394 D395	Q386-N390 PolarHBondContact NE2-OD1 2.9Å; Q386-N390 VanDerWaalsContact O-CB 3.27Å; Q386-N390 WeakPolarHBondContact O-CB 3.32Å; Q386-N390 PolarHBondContact O-N 3.45Å; Q386-N390 PolarHBondContact O-ND2 2.9Å; Q386-N390 PolarHBondContact O-OD1 3.49Å; V388-N390 VanDerWaalsContact C-N 3.34Å; V388-N390 PolarHBondContact O-N 2.91Å; N390-Q392 VanDerWaalsContact C-N 3.3Å; N390-Q392 PolarHBondContact O-N 2.67Å; N390-I394 HydrophobicContact CB-CD1 3.89Å; N390-I394 HydrophobicContact CB-CG1 4.44Å; N390-I394 WeakPolarHBondContact O-CA 3.49Å; N390-I394 VanDerWaalsContact O-CB 3.25Å; N390-I394 WeakPolarHBondContact O-CB 3.44Å; N390-I394 PolarHBondContact O-N 2.83Å; N390-I394 WeakPolarHBondContact OD1-CD1 3.36Å; N390-D395 PolarHBondContact O-N 3.01Å; N390-D395 VanDerWaalsContact O-N 3.09Å
391	T	95.3	Very high	93.2	Very high	0 Å²	0	63.2 Å²	63.2	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-66.1	-35.7	177.1	-55.7	0	0	0	0	111.4	F349 K353 Y366 A387 V388 T389 D395 G396 F397	F349-T391 WeakPolarHBondContact CZ-OG1 3.45Å; K353-T391 HydrophobicContact CD-CG2 3.78Å; K353-T391 PolarHBondContact NZ-OG1 3.19Å; Y366-T391 HydrophobicContact CD1-CG2 4.39Å; Y366-T391 HydrophobicContact CD2-CG2 4.02Å; Y366-T391 HydrophobicContact CG-CG2 3.91Å; A387-T391 PolarHBondContact O-N 2.85Å; A387-T391 VanDerWaalsContact O-N 3.09Å; A387-T391 PolarHBondContact O-OG1 3.15Å; V388-T391 WeakPolarHBondContact O-CA 2.93Å; V388-T391 WeakPolarHBondContact O-CB 3.31Å; V388-T391 PolarHBondContact O-N 3.02Å; T389-T391 VanDerWaalsContact C-N 3.26Å; T389-T391 PolarHBondContact O-N 3.19Å; T391-D395 WeakPolarHBondContact CA-OD2 3.18Å; T391-D395 WeakPolarHBondContact O-CB 3.26Å; T391-G396 PolarHBondContact O-N 2.78Å; T391-F397 HydrophobicContact CG2-CB 3.94Å; T391-F397 HydrophobicContact CG2-CD2 3.73Å; T391-F397 HydrophobicContact CG2-CG 4.04Å; T391-F397 PolarHBondContact O-N 3.24Å; T391-F397 VanDerWaalsContact O-N 3.11Å
392	Q	95.6	Very high	93.6	Very high	101 Å²	101	57.4 Å²	57.4	47%	0.472	31%	0.311	S	S	.	.	H	α-helix	trans	-72.5	-53.1	174.3	-170.2	173.2	-16.4	0	0	112.7	V388 T389 N390 G396 F397 V399	V388-Q392 PolarHBondContact O-N 2.98Å; T389-Q392 PolarHBondContact O-N 3.5Å; T389-Q392 VanDerWaalsContact O-N 3.17Å; N390-Q392 VanDerWaalsContact C-N 3.3Å; N390-Q392 PolarHBondContact O-N 2.67Å; Q392-G396 WeakPolarHBondContact O-CA 3.19Å; Q392-G396 PolarHBondContact O-N 3.08Å; Q392-F397 WeakPolarHBondContact CA-O 3.4Å; Q392-V399 HydrophobicContact CB-CB 4.38Å; Q392-V399 HydrophobicContact CB-CG2 3.69Å; Q392-V399 HydrophobicContact CG-CG2 4.32Å
393	V	94.7	Very high	93.7	Very high	110 Å²	110	55.7 Å²	55.7	67%	0.667	30%	0.301	S	S	*	.	H	α-helix	trans	-85.6	-42.6	-167.3	179.6	0	0	0	0	112.7	T389	T389-V393 HydrophobicContact CG2-CG2 4.14Å; T389-V393 WeakPolarHBondContact O-CG2 3.33Å; T389-V393 PolarHBondContact O-N 3.33Å
394	I	90.7	Very high	93.7	Very high	119 Å²	119	56 Å²	56	61%	0.61	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.6	-44.3	-175.3	-52.4	174.3	0	0	0	110.2	N390	N390-I394 HydrophobicContact CB-CD1 3.89Å; N390-I394 HydrophobicContact CB-CG1 4.44Å; N390-I394 WeakPolarHBondContact O-CA 3.49Å; N390-I394 VanDerWaalsContact O-CB 3.25Å; N390-I394 WeakPolarHBondContact O-CB 3.44Å; N390-I394 PolarHBondContact O-N 2.83Å; N390-I394 WeakPolarHBondContact OD1-CD1 3.36Å
395	D	89.3	Confident	93.7	Very high	34 Å²	34	56.1 Å²	56.1	18%	0.182	30%	0.302	C	S	.	.	S	Bend	trans	-83.9	-14.8	-178.2	-59.4	-64.4	0	0	0	113.5	K353 K357 N390 T391 F397	K353-D395 WeakPolarHBondContact CE-OD2 3.48Å; K353-D395 IonicContact NZ-OD2 2.92Å; K353-D395 PolarHBondContact NZ-OD2 3.11Å; K357-D395 VanDerWaalsContact CE-OD1 3.26Å; K357-D395 WeakPolarHBondContact CE-OD1 3.47Å; K357-D395 IonicContact NZ-OD1 3.21Å; K357-D395 PolarHBondContact NZ-OD1 3.5Å; N390-D395 PolarHBondContact O-N 3.01Å; N390-D395 VanDerWaalsContact O-N 3.09Å; T391-D395 WeakPolarHBondContact CA-OD2 3.18Å; T391-D395 WeakPolarHBondContact O-CB 3.26Å; D395-F397 VanDerWaalsContact C-N 3.32Å; D395-F397 HydrophobicContact CB-CD1 4.05Å; D395-F397 HydrophobicContact CB-CE1 4.18Å; D395-F397 HydrophobicContact CB-CG 4.49Å; D395-F397 VanDerWaalsContact O-CD1 3.31Å; D395-F397 WeakPolarHBondContact O-CD1 3.3Å
396	G	92.7	Very high	93.8	Very high	57 Å²	57	57 Å²	57	59%	0.588	30%	0.302	S	S	*	.			trans	72.9	21.4	177.2	0	0	0	0	0	113.9	T391 Q392	T391-G396 PolarHBondContact O-N 2.78Å; Q392-G396 WeakPolarHBondContact O-CA 3.19Å; Q392-G396 PolarHBondContact O-N 3.08Å
397	F	96.8	Very high	94	Very high	4 Å²	4	56.8 Å²	56.8	2%	0.018	30%	0.301	C	S	.	.			trans	-84	145.9	179.7	-69.3	14.7	0	0	0	109.7	K353 L356 K357 R364 Y366 T391 Q392 D395 V399	K353-F397 HydrophobicContact CB-CE2 4.3Å; K353-F397 HydrophobicContact CB-CZ 4.28Å; K353-F397 HydrophobicContact CD-CE2 4.4Å; K353-F397 HydrophobicContact CG-CE2 4Å; K353-F397 HydrophobicContact CG-CZ 4.47Å; L356-F397 HydrophobicContact CB-CE2 4.1Å; L356-F397 HydrophobicContact CB-CZ 3.83Å; L356-F397 HydrophobicContact CD1-CE2 3.81Å; L356-F397 HydrophobicContact CD1-CZ 4.4Å; K357-F397 HydrophobicContact CG-CE1 3.79Å; K357-F397 HydrophobicContact CG-CZ 4.02Å; R364-F397 HydrophobicContact CB-CB 4.43Å; R364-F397 HydrophobicContact CB-CD1 3.67Å; R364-F397 HydrophobicContact CB-CD2 4.06Å; R364-F397 HydrophobicContact CB-CE1 3.85Å; R364-F397 HydrophobicContact CB-CE2 4.21Å; R364-F397 HydrophobicContact CB-CG 3.8Å; R364-F397 HydrophobicContact CB-CZ 4.12Å; R364-F397 HydrophobicContact CG-CD1 4.14Å; R364-F397 HydrophobicContact CG-CE1 3.82Å; R364-F397 HydrophobicContact CG-CZ 4.04Å; Y366-F397 HydrophobicContact CD2-CD2 4.07Å; Y366-F397 HydrophobicContact CD2-CE2 4.46Å; T391-F397 HydrophobicContact CG2-CB 3.94Å; T391-F397 HydrophobicContact CG2-CD2 3.73Å; T391-F397 HydrophobicContact CG2-CG 4.04Å; T391-F397 PolarHBondContact O-N 3.24Å; T391-F397 VanDerWaalsContact O-N 3.11Å; Q392-F397 WeakPolarHBondContact CA-O 3.4Å; D395-F397 VanDerWaalsContact C-N 3.32Å; D395-F397 HydrophobicContact CB-CD1 4.05Å; D395-F397 HydrophobicContact CB-CE1 4.18Å; D395-F397 HydrophobicContact CB-CG 4.49Å; D395-F397 VanDerWaalsContact O-CD1 3.31Å; D395-F397 WeakPolarHBondContact O-CD1 3.3Å; F397-V399 PolarHBondContact O-N 3.32Å
398	F	97.6	Very high	94.1	Very high	123 Å²	123	56.3 Å²	56.3	54%	0.539	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	114.9	168.4	-175.6	-92.9	0	0	0	109.2	R364 V365 Y366 K400	R364-F398 PolarHBondContact O-N 3.36Å; V365-F398 CarbonylContact C-O 3.32Å; V365-F398 VanDerWaalsContact CA-O 3.27Å; V365-F398 WeakPolarHBondContact CA-O 3.12Å; V365-F398 HydrophobicContact CG1-CD1 4.21Å; V365-F398 HydrophobicContact CG2-CB 4.32Å; V365-F398 HydrophobicContact CG2-CD1 4.41Å; Y366-F398 PolarHBondContact N-O 3.48Å; F398-K400 HydrophobicContact CE1-CB 4.24Å
399	V	97.6	Very high	94.1	Very high	19 Å²	19	56 Å²	56	12%	0.115	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	124.1	179.1	174.6	0	0	0	0	109.7	Y366 V368 V388 Q392 F397 R401	Y366-V399 WeakPolarHBondContact O-CA 3.43Å; V368-V399 HydrophobicContact CG2-CG1 4.27Å; V388-V399 HydrophobicContact CG1-CG1 3.56Å; V388-V399 HydrophobicContact CG1-CG2 4.39Å; Q392-V399 HydrophobicContact CB-CB 4.38Å; Q392-V399 HydrophobicContact CB-CG2 3.69Å; Q392-V399 HydrophobicContact CG-CG2 4.32Å; F397-V399 PolarHBondContact O-N 3.32Å; V399-R401 HydrophobicContact CG1-CG 4.39Å
400	K	97.7	Very high	94.3	Very high	76 Å²	76	55.5 Å²	55.5	33%	0.33	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	123.4	169.2	178.3	67.4	180	-179	0	108.5	Y366 L367 V368 F398 T402 Y411	Y366-K400 PolarHBondContact O-N 3.29Å; L367-K400 CarbonylContact C-O 3.54Å; L367-K400 WeakPolarHBondContact CA-O 3.4Å; L367-K400 HydrophobicContact CD1-CB 3.88Å; L367-K400 HydrophobicContact CD1-CG 3.64Å; V368-K400 PolarHBondContact N-O 2.98Å; F398-K400 HydrophobicContact CE1-CB 4.24Å; K400-T402 HydrophobicContact CG-CG2 4.27Å; K400-Y411 HydrophobicContact CB-CE1 4.09Å; K400-Y411 HydrophobicContact CB-CE2 4.34Å; K400-Y411 HydrophobicContact CD-CD2 3.84Å; K400-Y411 HydrophobicContact CD-CE2 3.83Å; K400-Y411 HydrophobicContact CD-CG 4.36Å; K400-Y411 HydrophobicContact CG-CD1 3.97Å; K400-Y411 HydrophobicContact CG-CD2 3.84Å; K400-Y411 HydrophobicContact CG-CE1 3.95Å; K400-Y411 HydrophobicContact CG-CE2 3.82Å; K400-Y411 HydrophobicContact CG-CG 3.9Å
401	R	95.3	Very high	94.5	Very high	115 Å²	115	54.7 Å²	54.7	43%	0.434	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	140.2	170.4	-60.9	-178.9	-170.5	160.6	2.5	109.6	V368 V399	V368-R401 HydrophobicContact CB-CG 4.38Å; V368-R401 CarbonylContact O-C 3.59Å; V368-R401 WeakPolarHBondContact O-CA 3.49Å; V399-R401 HydrophobicContact CG1-CG 4.39Å
402	T	94.6	Very high	94.6	Very high	4 Å²	4	54.7 Å²	54.7	3%	0.025	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	142.4	175.8	49.3	0	0	0	0	109.6	L367 V368 E369 E370 K400 E407 S408	L367-T402 HydrophobicContact CD1-CG2 3.63Å; V368-T402 PolarHBondContact O-N 3.29Å; V368-T402 PolarHBondContact O-OG1 3.11Å; E369-T402 WeakPolarHBondContact CA-O 3.48Å; E370-T402 PolarHBondContact N-O 3.44Å; K400-T402 HydrophobicContact CG-CG2 4.27Å; T402-E407 HydrophobicContact CG2-CB 3.99Å; T402-S408 PolarHBondContact OG1-OG 2.96Å
403	A	91.5	Very high	94.7	Very high	48 Å²	48	50 Å²	50	40%	0.397	27%	0.268	S	S	.	.	S	Bend	trans	-70.9	-37.4	179.8	0	0	0	0	0	111.6	E370 E407	E370-A403 CarbonylContact C-O 3.49Å; A403-E407 PolarHBondContact N-OE2 3.43Å
404	D	89.4	Confident	94.8	Very high	59 Å²	59	50.4 Å²	50.4	32%	0.316	27%	0.265	S	S	.	.	S	Bend	trans	-152.6	-177.3	-175.4	67	25.6	0	0	0	112.6	K406 E407 S408	D404-K406 VanDerWaalsContact C-N 3.27Å; D404-K406 PolarHBondContact O-N 3.23Å; D404-K406 WeakPolarHBondContact OD1-CA 3.48Å; D404-K406 WeakPolarHBondContact OD1-CB 3.38Å; D404-K406 PolarHBondContact OD1-N 3.41Å; D404-E407 PolarHBondContact O-N 3.08Å; D404-E407 PolarHBondContact OD1-N 3.17Å; D404-S408 PolarHBondContact O-N 2.91Å; D404-S408 PolarHBondContact O-OG 3.48Å; D404-S408 VanDerWaalsContact O-OG 3.12Å
405	I	90.7	Very high	95.2	Very high	7 Å²	7	46.2 Å²	46.2	4%	0.036	24%	0.244	C	C	.	.	H	α-helix	trans	-65.9	-27.1	179.7	-157.8	168.8	0	0	0	113.5	H283 E286 L287 E369 S408 A409	H283-I405 HydrophobicContact CB-CD1 4.42Å; H283-I405 WeakPolarHBondContact O-CD1 3.4Å; E286-I405 HydrophobicContact CB-CD1 4.21Å; E286-I405 HydrophobicContact CG-CG2 4.01Å; L287-I405 HydrophobicContact CB-CD1 3.86Å; L287-I405 HydrophobicContact CB-CG1 4.09Å; L287-I405 HydrophobicContact CD1-CG1 4.2Å; E369-I405 WeakPolarHBondContact OE2-CA 3.48Å; I405-S408 WeakPolarHBondContact O-CB 3.45Å; I405-S408 PolarHBondContact O-N 3.1Å; I405-A409 WeakPolarHBondContact O-CB 3.37Å; I405-A409 PolarHBondContact O-N 3.4Å
406	K	92.9	Very high	95.6	Very high	102 Å²	102	44.7 Å²	44.7	44%	0.443	24%	0.236	S	C	.	.	H	α-helix	trans	-73.5	-42.2	178.6	-64.6	-179.3	175.4	175.4	0	110.1	E290 D404 A409 A410	E290-K406 HydrophobicContact CG-CG 4.05Å; E290-K406 WeakPolarHBondContact OE1-CE 3.39Å; D404-K406 VanDerWaalsContact C-N 3.27Å; D404-K406 PolarHBondContact O-N 3.23Å; D404-K406 WeakPolarHBondContact OD1-CA 3.48Å; D404-K406 WeakPolarHBondContact OD1-CB 3.38Å; D404-K406 PolarHBondContact OD1-N 3.41Å; K406-A409 PolarHBondContact O-N 3.09Å; K406-A410 WeakPolarHBondContact O-CB 3.48Å; K406-A410 PolarHBondContact O-N 3.45Å
407	E	95.2	Very high	95.8	Very high	98 Å²	98	47.5 Å²	47.5	46%	0.458	23%	0.229	S	C	.	.	H	α-helix	trans	-64.6	-40.3	171.6	-73.2	-166.5	179.7	0	0	112.1	T402 A403 D404 A409 A410 Y411	T402-E407 HydrophobicContact CG2-CB 3.99Å; A403-E407 PolarHBondContact N-OE2 3.43Å; D404-E407 PolarHBondContact O-N 3.08Å; D404-E407 PolarHBondContact OD1-N 3.17Å; E407-A409 VanDerWaalsContact C-N 3.35Å; E407-A409 PolarHBondContact O-N 2.79Å; E407-A410 PolarHBondContact O-N 3.03Å; E407-Y411 WeakPolarHBondContact O-CB 3.2Å; E407-Y411 PolarHBondContact O-N 3.34Å
408	S	95	Very high	95.8	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-56.8	-47.7	171.6	-67.2	0	0	0	0	111.4	E369 T402 D404 I405 Y411 L412	E369-S408 WeakPolarHBondContact OE2-CB 3.34Å; E369-S408 PolarHBondContact OE2-OG 3.14Å; T402-S408 PolarHBondContact OG1-OG 2.96Å; D404-S408 PolarHBondContact O-N 2.91Å; D404-S408 PolarHBondContact O-OG 3.48Å; D404-S408 VanDerWaalsContact O-OG 3.12Å; I405-S408 WeakPolarHBondContact O-CB 3.45Å; I405-S408 PolarHBondContact O-N 3.1Å; S408-Y411 PolarHBondContact O-N 3.4Å; S408-L412 WeakPolarHBondContact O-CG 3.43Å; S408-L412 PolarHBondContact O-N 3.06Å
409	A	95.8	Very high	95.8	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-63	-43.9	176.9	0	0	0	0	0	112.2	L287 E290 L291 L294 I405 K406 E407 Y411 L412 A413	L287-A409 HydrophobicContact CD1-CB 3.85Å; E290-A409 HydrophobicContact CB-CB 3.55Å; L291-A409 HydrophobicContact CD2-CB 4.34Å; L294-A409 HydrophobicContact CD1-CB 4.16Å; I405-A409 WeakPolarHBondContact O-CB 3.37Å; I405-A409 PolarHBondContact O-N 3.4Å; K406-A409 PolarHBondContact O-N 3.09Å; E407-A409 VanDerWaalsContact C-N 3.35Å; E407-A409 PolarHBondContact O-N 2.79Å; A409-Y411 VanDerWaalsContact C-N 3.34Å; A409-Y411 PolarHBondContact O-N 3.17Å; A409-L412 PolarHBondContact O-N 3.4Å; A409-A413 WeakPolarHBondContact O-CB 3.29Å; A409-A413 PolarHBondContact O-N 3.49Å
410	A	97.3	Very high	95.7	Very high	37 Å²	37	44.9 Å²	44.9	31%	0.306	22%	0.224	S	C	.	.	H	α-helix	trans	-61.6	-41.6	177.5	0	0	0	0	0	112	L294 K406 E407 A413 L414	L294-A410 HydrophobicContact CD1-CB 4.33Å; K406-A410 WeakPolarHBondContact O-CB 3.48Å; K406-A410 PolarHBondContact O-N 3.45Å; E407-A410 PolarHBondContact O-N 3.03Å; A410-A413 PolarHBondContact O-N 3.46Å; A410-L414 WeakPolarHBondContact O-CG 3.38Å; A410-L414 PolarHBondContact O-N 3.04Å
411	Y	98.1	Very high	95.6	Very high	36 Å²	36	49.6 Å²	49.6	14%	0.141	24%	0.24	C	C	.	.	H	α-helix	trans	-61.9	-47.9	174.9	175	-108.4	0	0	0	111.9	V365 L367 K400 E407 S408 A409 A413 L414 L415	V365-Y411 HydrophobicContact CG1-CE1 4.11Å; L367-Y411 HydrophobicContact CD1-CD1 3.96Å; L367-Y411 HydrophobicContact CD1-CE1 4.39Å; L367-Y411 HydrophobicContact CD2-CD1 4.42Å; K400-Y411 HydrophobicContact CB-CE1 4.09Å; K400-Y411 HydrophobicContact CB-CE2 4.34Å; K400-Y411 HydrophobicContact CD-CD2 3.84Å; K400-Y411 HydrophobicContact CD-CE2 3.83Å; K400-Y411 HydrophobicContact CD-CG 4.36Å; K400-Y411 HydrophobicContact CG-CD1 3.97Å; K400-Y411 HydrophobicContact CG-CD2 3.84Å; K400-Y411 HydrophobicContact CG-CE1 3.95Å; K400-Y411 HydrophobicContact CG-CE2 3.82Å; K400-Y411 HydrophobicContact CG-CG 3.9Å; E407-Y411 WeakPolarHBondContact O-CB 3.2Å; E407-Y411 PolarHBondContact O-N 3.34Å; S408-Y411 PolarHBondContact O-N 3.4Å; A409-Y411 VanDerWaalsContact C-N 3.34Å; A409-Y411 PolarHBondContact O-N 3.17Å; Y411-A413 VanDerWaalsContact C-N 3.3Å; Y411-A413 PolarHBondContact O-N 3.16Å; Y411-L414 PolarHBondContact O-N 3.34Å; Y411-L415 HydrophobicContact CE1-CD2 4.14Å; Y411-L415 WeakPolarHBondContact O-CB 3.4Å; Y411-L415 PolarHBondContact O-N 3.37Å
412	L	97.9	Very high	95.6	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-61.7	-38	176.7	-68	172.4	0	0	0	111.9	L271 L287 L291 F308 W310 V332 S408 A409 T416	L271-L412 HydrophobicContact CD2-CB 4.33Å; L287-L412 HydrophobicContact CD1-CD1 4.44Å; L291-L412 HydrophobicContact CD2-CB 4.17Å; F308-L412 HydrophobicContact CB-CD2 4.36Å; F308-L412 HydrophobicContact CD1-CD1 3.85Å; F308-L412 HydrophobicContact CD1-CD2 4.46Å; F308-L412 HydrophobicContact CD2-CD1 4.26Å; F308-L412 HydrophobicContact CD2-CD2 4.25Å; F308-L412 HydrophobicContact CE1-CD1 3.67Å; F308-L412 HydrophobicContact CE2-CD1 4.13Å; F308-L412 HydrophobicContact CG-CD1 4.15Å; F308-L412 HydrophobicContact CG-CD2 4.08Å; F308-L412 HydrophobicContact CZ-CD1 3.84Å; W310-L412 HydrophobicContact CH2-CD2 4.29Å; W310-L412 HydrophobicContact CZ2-CD2 4.35Å; V332-L412 HydrophobicContact CG2-CD2 4.23Å; S408-L412 WeakPolarHBondContact O-CG 3.43Å; S408-L412 PolarHBondContact O-N 3.06Å; A409-L412 PolarHBondContact O-N 3.4Å; L412-T416 WeakPolarHBondContact O-CB 3.23Å; L412-T416 PolarHBondContact O-N 3.31Å; L412-T416 PolarHBondContact O-OG1 2.91Å
413	A	97.8	Very high	95.6	Very high	3 Å²	3	46.6 Å²	46.6	3%	0.025	23%	0.232	C	C	.	.	H	α-helix	trans	-63.7	-47.9	176.1	0	0	0	0	0	112.2	L294 V296 A409 A410 Y411 T416 R417	L294-A413 HydrophobicContact CB-CB 4.05Å; L294-A413 HydrophobicContact CD1-CB 3.87Å; V296-A413 HydrophobicContact CG2-CB 3.35Å; A409-A413 WeakPolarHBondContact O-CB 3.29Å; A409-A413 PolarHBondContact O-N 3.49Å; A410-A413 PolarHBondContact O-N 3.46Å; Y411-A413 VanDerWaalsContact C-N 3.3Å; Y411-A413 PolarHBondContact O-N 3.16Å; A413-T416 PolarHBondContact O-N 3.28Å; A413-R417 WeakPolarHBondContact O-CG 3.49Å; A413-R417 PolarHBondContact O-N 3.5Å
414	L	97.9	Very high	95.7	Very high	117 Å²	117	50.6 Å²	50.6	61%	0.613	24%	0.243	S	C	*	.	H	α-helix	trans	-63.2	-42.8	177.3	-72.8	172.7	0	0	0	111.7	A410 Y411 T416 R417 G418	A410-L414 WeakPolarHBondContact O-CG 3.38Å; A410-L414 PolarHBondContact O-N 3.04Å; Y411-L414 PolarHBondContact O-N 3.34Å; L414-T416 VanDerWaalsContact C-N 3.34Å; L414-R417 PolarHBondContact O-N 3.16Å; L414-G418 PolarHBondContact O-N 3.31Å
415	L	97.6	Very high	95.9	Very high	32 Å²	32	50.9 Å²	50.9	17%	0.168	26%	0.259	C	S	.	.	H	α-helix	trans	-63.9	-41.4	177.4	-175.3	53.5	0	0	0	111.2	W310 Y411 G418 L419	W310-L415 HydrophobicContact CH2-CD2 3.25Å; W310-L415 HydrophobicContact CH2-CG 3.76Å; W310-L415 HydrophobicContact CZ2-CB 4.12Å; W310-L415 HydrophobicContact CZ2-CD2 3.68Å; W310-L415 HydrophobicContact CZ2-CG 3.68Å; W310-L415 HydrophobicContact CZ3-CD2 4.05Å; Y411-L415 HydrophobicContact CE1-CD2 4.14Å; Y411-L415 WeakPolarHBondContact O-CB 3.4Å; Y411-L415 PolarHBondContact O-N 3.37Å; L415-G418 PolarHBondContact O-N 3.21Å; L415-L419 HydrophobicContact CD1-CD1 4.41Å; L415-L419 HydrophobicContact CD1-CG 4.3Å; L415-L419 HydrophobicContact CG-CD1 4.3Å; L415-L419 WeakPolarHBondContact O-CG 3.31Å; L415-L419 PolarHBondContact O-N 3.1Å
416	T	97.9	Very high	96.1	Very high	2 Å²	2	53.5 Å²	53.5	1%	0.012	27%	0.271	C	S	.	.	H	α-helix	trans	-60.1	-48.6	175.4	-56.7	0	0	0	0	111.6	V296 W310 L412 A413 L414 G418 L419 Q420	V296-T416 HydrophobicContact CG1-CG2 4.15Å; W310-T416 PolarHBondContact NE1-OG1 2.96Å; L412-T416 WeakPolarHBondContact O-CB 3.23Å; L412-T416 PolarHBondContact O-N 3.31Å; L412-T416 PolarHBondContact O-OG1 2.91Å; A413-T416 PolarHBondContact O-N 3.28Å; L414-T416 VanDerWaalsContact C-N 3.34Å; T416-G418 VanDerWaalsContact C-N 3.3Å; T416-G418 PolarHBondContact O-N 3.44Å; T416-L419 PolarHBondContact O-N 2.98Å; T416-Q420 VanDerWaalsContact O-CG 3.3Å; T416-Q420 WeakPolarHBondContact O-CG 3.42Å; T416-Q420 PolarHBondContact O-N 3.3Å
417	R	97.6	Very high	96.2	Very high	115 Å²	115	51 Å²	51	43%	0.434	26%	0.264	S	S	.	.	H	α-helix	trans	-65	-34.2	176.6	-66.8	173	-174.9	177.8	1.6	112.4	L294 A413 L414 R421	L294-R417 PolarHBondContact O-NH2 3.46Å; A413-R417 WeakPolarHBondContact O-CG 3.49Å; A413-R417 PolarHBondContact O-N 3.5Å; L414-R417 PolarHBondContact O-N 3.16Å; R417-R421 WeakPolarHBondContact O-CG 3.34Å; R417-R421 PolarHBondContact O-N 3.33Å; R417-R421 VanDerWaalsContact O-N 3.16Å
418	G	96.9	Very high	96.2	Very high	26 Å²	26	46.3 Å²	46.3	27%	0.268	24%	0.242	S	C	.	.	H	α-helix	trans	-62.5	-48.9	173.3	0	0	0	0	0	111.7	L414 L415 T416 R421 L422	L414-G418 PolarHBondContact O-N 3.31Å; L415-G418 PolarHBondContact O-N 3.21Å; T416-G418 VanDerWaalsContact C-N 3.3Å; T416-G418 PolarHBondContact O-N 3.44Å; G418-R421 PolarHBondContact O-N 3.13Å; G418-L422 WeakPolarHBondContact O-CB 3.45Å; G418-L422 PolarHBondContact O-N 3.36Å
419	L	96.4	Very high	96.1	Very high	4 Å²	4	53.2 Å²	53.2	2%	0.021	27%	0.268	C	S	.	.	H	α-helix	trans	-66	-40.4	177.8	-68.3	173.4	0	0	0	112	V269 W310 L328 H330 L415 T416 R421 L422 Y423	V269-L419 HydrophobicContact CG1-CB 4.4Å; W310-L419 HydrophobicContact CB-CD1 4.16Å; W310-L419 HydrophobicContact CD2-CD1 3.34Å; W310-L419 HydrophobicContact CE3-CD1 3.74Å; W310-L419 HydrophobicContact CG-CD1 3.52Å; W310-L419 HydrophobicContact CZ2-CD1 4.3Å; W310-L419 HydrophobicContact CZ3-CD1 4.37Å; L328-L419 HydrophobicContact CD2-CB 4.19Å; L328-L419 HydrophobicContact CD2-CD1 4.26Å; L328-L419 HydrophobicContact CD2-CD2 4.38Å; H330-L419 HydrophobicContact CB-CD1 4.42Å; L415-L419 HydrophobicContact CD1-CD1 4.41Å; L415-L419 HydrophobicContact CD1-CG 4.3Å; L415-L419 HydrophobicContact CG-CD1 4.3Å; L415-L419 WeakPolarHBondContact O-CG 3.31Å; L415-L419 PolarHBondContact O-N 3.1Å; T416-L419 PolarHBondContact O-N 2.98Å; L419-R421 VanDerWaalsContact C-N 3.32Å; L419-R421 PolarHBondContact O-N 3.43Å; L419-L422 HydrophobicContact CD2-CD2 4.19Å; L419-L422 PolarHBondContact O-N 2.85Å; L419-Y423 HydrophobicContact CD2-CE2 4.2Å; L419-Y423 WeakPolarHBondContact O-CB 3.1Å; L419-Y423 VanDerWaalsContact O-CD2 3.31Å; L419-Y423 WeakPolarHBondContact O-CD2 3.42Å; L419-Y423 PolarHBondContact O-N 3.33Å
420	Q	96.4	Very high	96	Very high	61 Å²	61	54.6 Å²	54.6	29%	0.285	28%	0.278	S	S	.	.	H	α-helix	trans	-55.4	-47.8	173.7	-75.7	168.3	-14.8	0	0	111.5	V269 T416 Q424	V269-Q420 HydrophobicContact CB-CG 3.98Å; V269-Q420 HydrophobicContact CG1-CG 4.45Å; V269-Q420 PolarHBondContact O-NE2 2.9Å; T416-Q420 VanDerWaalsContact O-CG 3.3Å; T416-Q420 WeakPolarHBondContact O-CG 3.42Å; T416-Q420 PolarHBondContact O-N 3.3Å; Q420-Q424 WeakPolarHBondContact O-CG 3.17Å; Q420-Q424 PolarHBondContact O-N 2.76Å
421	R	96	Very high	95.5	Very high	175 Å²	175	54.6 Å²	54.6	66%	0.66	27%	0.27	S	S	*	.	H	α-helix	trans	-66.6	-41.9	176.4	-71.9	-175.5	-66.9	162.1	-0.4	112.9	R417 G418 L419 Y423 Q424	R417-R421 WeakPolarHBondContact O-CG 3.34Å; R417-R421 PolarHBondContact O-N 3.33Å; R417-R421 VanDerWaalsContact O-N 3.16Å; G418-R421 PolarHBondContact O-N 3.13Å; L419-R421 VanDerWaalsContact C-N 3.32Å; L419-R421 PolarHBondContact O-N 3.43Å; R421-Y423 VanDerWaalsContact C-N 3.26Å; R421-Y423 PolarHBondContact O-N 3.08Å; R421-Q424 WeakPolarHBondContact O-CB 3.28Å; R421-Q424 PolarHBondContact O-N 3.46Å
422	L	95.3	Very high	94.6	Very high	55 Å²	55	56.9 Å²	56.9	29%	0.288	29%	0.29	S	S	.	.	H	α-helix	trans	-60.5	-38.4	-179.4	-179.2	67.9	0	0	0	112	G418 L419 H426 N448 P449	G418-L422 WeakPolarHBondContact O-CB 3.45Å; G418-L422 PolarHBondContact O-N 3.36Å; L419-L422 HydrophobicContact CD2-CD2 4.19Å; L419-L422 PolarHBondContact O-N 2.85Å; L422-H426 PolarHBondContact O-CE1 3.4Å; L422-H426 PolarHBondContact O-ND1 3.15Å; L422-N448 WeakPolarHBondContact CD2-OD1 3.48Å; L422-P449 HydrophobicContact CD2-CB 4.22Å; L422-P449 HydrophobicContact CG-CB 4Å; L422-P449 HydrophobicContact CG-CG 4.34Å
423	Y	94.9	Very high	93.4	Very high	2 Å²	2	62 Å²	62	1%	0.008	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.3	4.7	-178.7	-77.1	-88.8	0	0	0	113.4	Y267 L328 L419 R421 H426 L428 P449 L450	Y267-Y423 PolarHBondContact OH-O 2.87Å; L328-Y423 HydrophobicContact CD2-CD2 3.66Å; L328-Y423 HydrophobicContact CD2-CE2 3.41Å; L328-Y423 VanDerWaalsContact CD2-CE2 3.41Å; L328-Y423 HydrophobicContact CD2-CG 4.39Å; L328-Y423 HydrophobicContact CG-CD2 4.36Å; L328-Y423 HydrophobicContact CG-CE1 4.33Å; L328-Y423 HydrophobicContact CG-CE2 3.83Å; L419-Y423 HydrophobicContact CD2-CE2 4.2Å; L419-Y423 WeakPolarHBondContact O-CB 3.1Å; L419-Y423 VanDerWaalsContact O-CD2 3.31Å; L419-Y423 WeakPolarHBondContact O-CD2 3.42Å; L419-Y423 PolarHBondContact O-N 3.33Å; R421-Y423 VanDerWaalsContact C-N 3.26Å; R421-Y423 PolarHBondContact O-N 3.08Å; Y423-H426 PolarHBondContact O-N 3.39Å; Y423-L428 HydrophobicContact CD1-CD1 4.45Å; Y423-L428 HydrophobicContact CD1-CD2 3.7Å; Y423-L428 HydrophobicContact CE1-CD2 3.75Å; Y423-P449 HydrophobicContact CD1-CB 3.88Å; Y423-P449 HydrophobicContact CD2-CB 4.29Å; Y423-P449 HydrophobicContact CE1-CB 3.53Å; Y423-P449 HydrophobicContact CE2-CB 3.93Å; Y423-P449 HydrophobicContact CG-CB 4.29Å; Y423-L450 WeakPolarHBondContact CE1-O 3.22Å; Y423-L450 PolarHBondContact OH-O 3.15Å
424	Q	93.6	Very high	91.6	Very high	132 Å²	132	64.9 Å²	64.9	62%	0.617	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	137.6	171.4	-84.4	163	5.8	0	0	110.1	Q420 R421 H426	Q420-Q424 WeakPolarHBondContact O-CG 3.17Å; Q420-Q424 PolarHBondContact O-N 2.76Å; R421-Q424 WeakPolarHBondContact O-CB 3.28Å; R421-Q424 PolarHBondContact O-N 3.46Å; Q424-H426 PolarHBondContact O-N 3.1Å; Q424-H426 PolarHBondContact O-ND1 3.3Å
425	G	92.5	Very high	89.1	Confident	64 Å²	64	63.4 Å²	63.4	66%	0.66	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.3	6	177.4	0	0	0	0	0	115.6	P264	P264-G425 VanDerWaalsContact CG-C 3.41Å; P264-G425 WeakPolarHBondContact CG-O 3.14Å
426	H	94.4	Very high	86.6	Confident	63 Å²	63	66 Å²	66	29%	0.292	35%	0.354	S	S	.	.			trans	-101.9	146.5	-179.6	-68.6	75.4	0	0	0	112.2	P264 Y267 L422 Y423 Q424 P449	P264-H426 WeakPolarHBondContact CG-O 3.21Å; Y267-H426 WeakPolarHBondContact CE1-O 3.37Å; Y267-H426 PolarHBondContact OH-O 3.38Å; L422-H426 PolarHBondContact O-CE1 3.4Å; L422-H426 PolarHBondContact O-ND1 3.15Å; Y423-H426 PolarHBondContact O-N 3.39Å; Q424-H426 PolarHBondContact O-N 3.1Å; Q424-H426 PolarHBondContact O-ND1 3.3Å; H426-P449 VanDerWaalsContact CD2-CG 3.44Å; H426-P449 WeakPolarHBondContact CD2-CG 3.08Å; H426-P449 WeakPolarHBondContact NE2-CG 3.33Å
427	T	94.9	Very high	83.8	Confident	48 Å²	48	69.2 Å²	69.2	29%	0.294	39%	0.387	S	S	.	.			trans	-95.8	130.2	170.1	-59.1	0	0	0	0	108.8	E261 L262 R263 C451	E261-T427 HydrophobicContact CG-CG2 3.57Å; L262-T427 CarbonylContact O-C 3.55Å; L262-T427 WeakPolarHBondContact O-CA 3.16Å; R263-T427 HydrophobicContact CG-CG2 4.28Å; T427-C451 WeakPolarHBondContact O-CB 3.45Å
428	L	95	Very high	80.7	Confident	0 Å²	0	69.9 Å²	69.9	0%	0	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	140.8	-179	-58.4	179.7	0	0	0	110.7	E261 L262 Y267 A312 L326 Y423 C451 L453	E261-L428 CarbonylContact C-O 3.59Å; E261-L428 VanDerWaalsContact CA-O 3.31Å; E261-L428 WeakPolarHBondContact CA-O 3.49Å; L262-L428 HydrophobicContact CB-CB 4.31Å; L262-L428 PolarHBondContact N-O 3.03Å; L262-L428 PolarHBondContact O-N 3.03Å; Y267-L428 HydrophobicContact CD1-CD1 4.46Å; Y267-L428 HydrophobicContact CD2-CD1 4.06Å; Y267-L428 HydrophobicContact CE1-CD1 4.08Å; Y267-L428 HydrophobicContact CE1-CG 4.15Å; Y267-L428 HydrophobicContact CE2-CD1 3.69Å; Y267-L428 HydrophobicContact CE2-CG 4.47Å; Y267-L428 HydrophobicContact CG-CD1 4.43Å; A312-L428 HydrophobicContact CB-CD1 3.33Å; L326-L428 HydrophobicContact CD1-CB 3.61Å; Y423-L428 HydrophobicContact CD1-CD1 4.45Å; Y423-L428 HydrophobicContact CD1-CD2 3.7Å; Y423-L428 HydrophobicContact CE1-CD2 3.75Å; L428-C451 HydrophobicContact CD2-CB 4.28Å; L428-L453 HydrophobicContact CD1-CD1 4.07Å; L428-L453 HydrophobicContact CD2-CD1 3.87Å; L428-L453 HydrophobicContact CG-CD1 4.4Å
429	R	93.6	Very high	78	Confident	145 Å²	145	74.4 Å²	74.4	55%	0.547	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	140.8	-179.2	-65.9	-179.6	176.7	140.3	2.4	111.2	L260 E261 C451 L453	L260-R429 CarbonylContact O-C 3.53Å; L260-R429 WeakPolarHBondContact O-CA 3.49Å; E261-R429 HydrophobicContact CB-CG 4.46Å; E261-R429 HydrophobicContact CG-CG 4.14Å; E261-R429 IonicContact OE2-CZ 2.67Å; E261-R429 IonicContact OE2-NE 2.7Å; E261-R429 PolarHBondContact OE2-NE 2.88Å; E261-R429 IonicContact OE2-NH2 3.95Å; E261-R429 PolarHBondContact OE2-NH2 3.45Å; R429-C451 PolarHBondContact N-O 3.1Å; R429-L453 PolarHBondContact O-N 3.42Å
430	S	92.9	Very high	75	Confident	29 Å²	29	82.3 Å²	82.3	20%	0.203	46%	0.461	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67	141.1	171.9	62.2	0	0	0	0	111.6	P259 L260 L453	P259-S430 WeakPolarHBondContact CA-OG 3.39Å; L260-S430 PolarHBondContact N-OG 3.21Å; L260-S430 PolarHBondContact O-N 2.98Å; S430-L453 CarbonylContact C-O 3.55Å; S430-L453 VanDerWaalsContact CA-O 3.28Å; S430-L453 WeakPolarHBondContact CA-O 3.36Å
431	R	86.9	Confident	72.2	Confident	38 Å²	38	84.6 Å²	84.6	14%	0.143	48%	0.483	C	S	.	.			trans	-120.7	144.1	166.8	75.2	-174.3	177.8	176.6	-1.1	110.6	G360 S452 L453 L454	G360-R431 PolarHBondContact O-NH2 2.94Å; R431-S452 WeakPolarHBondContact CB-OG 3.46Å; R431-S452 WeakPolarHBondContact CD-O 3.44Å; R431-L453 PolarHBondContact N-O 2.94Å; R431-L454 HydrophobicContact CG-CD2 3.9Å; R431-L454 HydrophobicContact CG-CG 4.36Å
432	P	81	Confident	69.3	Low	84 Å²	84	79.3 Å²	79.3	55%	0.545	48%	0.483	S	S	.	.			trans	-69.1	157.5	173.8	29.2	-33.2	0	0	0	111.4	G434	P432-G434 PolarHBondContact O-N 3.03Å
433	W	72.3	Confident	66.5	Low	107 Å²	107	81.9 Å²	81.9	41%	0.405	51%	0.513	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.2	118.4	173.5	-164.4	-82.9	0	0	0	110.1	C359 L454 D458	C359-W433 VanDerWaalsContact O-CH2 3.25Å; C359-W433 WeakPolarHBondContact O-CH2 3.49Å; W433-L454 HydrophobicContact CE3-CD1 4.03Å; W433-L454 HydrophobicContact CE3-CD2 4Å; W433-L454 HydrophobicContact CZ3-CD1 3.75Å; W433-D458 HydrophobicContact CE3-CB 4.45Å
434	G	60	Low	64.1	Low	64 Å²	64	89.5 Å²	89.5	66%	0.66	55%	0.55	S	S	*	*	T	Hydrogen-bonded Turn	trans	110.1	1.1	171.3	0	0	0	0	0	117.2	P432 P436	P432-G434 PolarHBondContact O-N 3.03Å; G434-P436 WeakPolarHBondContact O-CD 3.48Å
435	T	44.1	Very low	62.2	Low	86 Å²	86	88.3 Å²	88.3	53%	0.528	55%	0.554	S	S	.	*			trans	-109.7	77.4	165.2	55.2	0	0	0	0	111
436	P	45.4	Very low	60.6	Low	87 Å²	87	87.2 Å²	87.2	57%	0.565	54%	0.536	S	S	*	.			trans	-63.2	133.5	141.2	30.1	-24.1	0	0	0	105.6	G434 N438	G434-P436 WeakPolarHBondContact O-CD 3.48Å; P436-N438 PolarHBondContact O-N 3.29Å
437	G	40.6	Very low	59.3	Low	69 Å²	69	88.8 Å²	88.8	71%	0.711	55%	0.552	S	S	*	*			trans	-46.7	147.2	178.3	0	0	0	0	0	111.2	P439	G437-P439 VanDerWaalsContact O-N 3.12Å
438	N	31.3	Very low	58.2	Low	129 Å²	129	91 Å²	91	69%	0.69	56%	0.562	S	S	*	*			trans	-33.4	119.6	177	-112.2	3.4	0	0	0	110.8	P436 E440	P436-N438 PolarHBondContact O-N 3.29Å; N438-E440 PolarHBondContact O-N 2.96Å
439	P	39.6	Very low	57.6	Low	121 Å²	121	91.8 Å²	91.8	79%	0.786	57%	0.567	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.8	12.8	178.5	28	-32.7	0	0	0	113.2	G437	G437-P439 VanDerWaalsContact O-N 3.12Å
440	E	35.2	Very low	57.3	Low	170 Å²	170	86 Å²	86	79%	0.794	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.2	-4.1	-179.1	-63.8	-162.4	153.4	0	0	114.4	N438	N438-E440 PolarHBondContact O-N 2.96Å
441	S	36.3	Very low	57.1	Low	108 Å²	108	86.5 Å²	86.5	76%	0.755	55%	0.55	S	S	*	*	S	Bend	trans	-102.7	112.6	168.4	-64.6	0	0	0	0	109
442	G	35.3	Very low	57.3	Low	64 Å²	64	87.2 Å²	87.2	66%	0.66	56%	0.561	S	S	*	*			trans	-40.8	141.9	-170.5	0	0	0	0	0	115.7	M444	G442-M444 VanDerWaalsContact C-N 3.29Å; G442-M444 PolarHBondContact O-N 3.48Å
443	A	37.4	Very low	57.9	Low	109 Å²	109	83.3 Å²	83.3	90%	0.901	54%	0.535	S	S	*	.			trans	-25.7	72	174.3	0	0	0	0	0	117.1
444	M	44.1	Very low	58.9	Low	163 Å²	163	78.5 Å²	78.5	80%	0.803	52%	0.518	S	S	*	.	P	Polyproline II helix	trans	-85	133.1	160.2	-72.4	-62.5	-72.4	0	0	107.8	G442 S446	G442-M444 VanDerWaalsContact C-N 3.29Å; G442-M444 PolarHBondContact O-N 3.48Å; M444-S446 PolarHBondContact O-N 3.14Å
445	P	53.5	Low	60.5	Low	107 Å²	107	76.8 Å²	76.8	70%	0.695	50%	0.495	S	S	*	.	P	Polyproline II helix	trans	-56.5	130.5	173.3	20.3	-27.9	0	0	0	108.9
446	S	58.3	Low	62.9	Low	41 Å²	41	73.8 Å²	73.8	29%	0.287	47%	0.474	S	S	.	.	P	Polyproline II helix	trans	-51.1	128.6	177.8	20.3	0	0	0	0	109.3	E362 M444 N448	E362-S446 PolarHBondContact OE2-OG 3.4Å; M444-S446 PolarHBondContact O-N 3.14Å; S446-N448 PolarHBondContact O-N 3.14Å
447	P	67.3	Low	65.1	Low	96 Å²	96	73.7 Å²	73.7	62%	0.623	48%	0.476	S	S	*	.	P	Polyproline II helix	trans	-57.8	136.2	-175.1	21.9	-31.8	0	0	0	109.7	P449 L450	P447-P449 CarbonylContact O-C 3.6Å; P447-L450 PolarHBondContact O-N 3.22Å
448	N	72.6	Confident	67.5	Low	94 Å²	94	73.5 Å²	73.5	50%	0.503	46%	0.458	S	S	.	.	S	Bend	trans	-112.8	115.7	175.6	-166.1	26.4	0	0	0	108.1	L422 S446	L422-N448 WeakPolarHBondContact CD2-OD1 3.48Å; S446-N448 PolarHBondContact O-N 3.14Å
449	P	82.3	Confident	70.5	Confident	17 Å²	17	67.3 Å²	67.3	11%	0.11	43%	0.425	C	S	.	.	S	Bend	cis	-76.4	151.5	5.8	28.8	-32.4	0	0	0	114.9	L422 Y423 H426 P447 C451	L422-P449 HydrophobicContact CD2-CB 4.22Å; L422-P449 HydrophobicContact CG-CB 4Å; L422-P449 HydrophobicContact CG-CG 4.34Å; Y423-P449 HydrophobicContact CD1-CB 3.88Å; Y423-P449 HydrophobicContact CD2-CB 4.29Å; Y423-P449 HydrophobicContact CE1-CB 3.53Å; Y423-P449 HydrophobicContact CE2-CB 3.93Å; Y423-P449 HydrophobicContact CG-CB 4.29Å; H426-P449 VanDerWaalsContact CD2-CG 3.44Å; H426-P449 WeakPolarHBondContact CD2-CG 3.08Å; H426-P449 WeakPolarHBondContact NE2-CG 3.33Å; P447-P449 CarbonylContact O-C 3.6Å; P449-C451 PolarHBondContact O-N 3.23Å
450	L	86.7	Confident	73	Confident	22 Å²	22	62.6 Å²	62.6	12%	0.115	39%	0.394	C	S	.	.			trans	-79.4	114.5	168.7	-177.8	69.5	0	0	0	108.8	D329 Y423 P447 S452 L453	D329-L450 HydrophobicContact CB-CB 4.37Å; D329-L450 HydrophobicContact CB-CD2 3.9Å; Y423-L450 WeakPolarHBondContact CE1-O 3.22Å; Y423-L450 PolarHBondContact OH-O 3.15Å; P447-L450 PolarHBondContact O-N 3.22Å; L450-S452 WeakPolarHBondContact CD2-O 3.33Å; L450-S452 WeakPolarHBondContact CG-O 3.3Å; L450-L453 HydrophobicContact CB-CD2 4.29Å; L450-L453 HydrophobicContact CD2-CD2 3.99Å; L450-L453 HydrophobicContact CG-CD2 4.06Å; L450-L453 VanDerWaalsContact O-CD2 3.26Å; L450-L453 WeakPolarHBondContact O-CD2 3.32Å
451	C	89.8	Confident	75.5	Confident	40 Å²	40	57.1 Å²	57.1	27%	0.27	38%	0.377	S	S	.	.			trans	-94.3	-10.6	179.7	-65.2	0	0	0	0	114	T427 L428 R429 P449	T427-C451 WeakPolarHBondContact O-CB 3.45Å; L428-C451 HydrophobicContact CD2-CB 4.28Å; R429-C451 PolarHBondContact N-O 3.1Å; P449-C451 PolarHBondContact O-N 3.23Å
452	S	91.2	Very high	77.7	Confident	54 Å²	54	52.9 Å²	52.9	38%	0.378	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	101.4	174.5	-176.6	0	0	0	0	109.2	R431 L450	R431-S452 WeakPolarHBondContact CB-OG 3.46Å; R431-S452 WeakPolarHBondContact CD-O 3.44Å; L450-S452 WeakPolarHBondContact CD2-O 3.33Å; L450-S452 WeakPolarHBondContact CG-O 3.3Å
453	L	92.8	Very high	80.1	Confident	1 Å²	1	50.1 Å²	50.1	1%	0.005	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	151.9	-165	-64.4	-178.3	0	0	0	111.7	L326 L328 L428 R429 S430 R431 L450	L326-L453 HydrophobicContact CB-CB 3.97Å; L326-L453 HydrophobicContact CB-CD1 4.09Å; L328-L453 HydrophobicContact CD1-CD1 4.1Å; L328-L453 HydrophobicContact CG-CD1 4.44Å; L428-L453 HydrophobicContact CD1-CD1 4.07Å; L428-L453 HydrophobicContact CD2-CD1 3.87Å; L428-L453 HydrophobicContact CG-CD1 4.4Å; R429-L453 PolarHBondContact O-N 3.42Å; S430-L453 CarbonylContact C-O 3.55Å; S430-L453 VanDerWaalsContact CA-O 3.28Å; S430-L453 WeakPolarHBondContact CA-O 3.36Å; R431-L453 PolarHBondContact N-O 2.94Å; L450-L453 HydrophobicContact CB-CD2 4.29Å; L450-L453 HydrophobicContact CD2-CD2 3.99Å; L450-L453 HydrophobicContact CG-CD2 4.06Å; L450-L453 VanDerWaalsContact O-CD2 3.26Å; L450-L453 WeakPolarHBondContact O-CD2 3.32Å
454	L	92.8	Very high	82.2	Confident	6 Å²	6	48.4 Å²	48.4	3%	0.031	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	151.2	173	-66.1	166.3	0	0	0	109.5	L326 V327 L361 R431 W433	L326-L454 CarbonylContact C-O 3.57Å; L326-L454 WeakPolarHBondContact CA-O 3.39Å; V327-L454 HydrophobicContact CG1-CB 3.74Å; V327-L454 WeakPolarHBondContact CG1-O 3.44Å; V327-L454 PolarHBondContact N-O 3.31Å; L361-L454 HydrophobicContact CD2-CD1 4.42Å; R431-L454 HydrophobicContact CG-CD2 3.9Å; R431-L454 HydrophobicContact CG-CG 4.36Å; W433-L454 HydrophobicContact CE3-CD1 4.03Å; W433-L454 HydrophobicContact CE3-CD2 4Å; W433-L454 HydrophobicContact CZ3-CD1 3.75Å
455	T	94.6	Very high	83.3	Confident	29 Å²	29	47.1 Å²	47.1	18%	0.178	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	151	165.5	75.1	0	0	0	0	109.6	E325 L326 S457 D458 F459	E325-T455 WeakPolarHBondContact O-CA 3.3Å; L326-T455 HydrophobicContact CD2-CG2 4.24Å; T455-S457 PolarHBondContact O-N 3.39Å; T455-D458 PolarHBondContact O-N 3.04Å; T455-D458 WeakPolarHBondContact OG1-CB 3.42Å; T455-D458 PolarHBondContact OG1-N 2.86Å; T455-D458 PolarHBondContact OG1-OD2 3.2Å; T455-F459 WeakPolarHBondContact O-CB 3.39Å; T455-F459 PolarHBondContact O-N 3.46Å
456	F	94.2	Very high	83.9	Confident	23 Å²	23	48.9 Å²	48.9	10%	0.101	29%	0.29	C	S	.	.	H	α-helix	trans	-60.6	-36.1	176.3	178.6	-101.4	0	0	0	111.8	R301 L303 V309 V311 E325 F459 N460	R301-F456 HydrophobicContact CB-CZ 4.5Å; L303-F456 HydrophobicContact CD2-CE2 3.78Å; L303-F456 HydrophobicContact CD2-CZ 3.93Å; V309-F456 HydrophobicContact CG2-CE2 4.44Å; V311-F456 HydrophobicContact CG1-CB 4.41Å; V311-F456 HydrophobicContact CG1-CD2 3.65Å; V311-F456 HydrophobicContact CG1-CE2 4.31Å; V311-F456 HydrophobicContact CG1-CG 4.28Å; E325-F456 HydrophobicContact CB-CB 3.98Å; E325-F456 PolarHBondContact O-N 3.46Å; F456-F459 HydrophobicContact CD2-CD1 4.45Å; F456-N460 HydrophobicContact CE1-CB 4.47Å; F456-N460 HydrophobicContact CZ-CB 4.44Å; F456-N460 WeakPolarHBondContact O-CB 3.49Å; F456-N460 PolarHBondContact O-N 2.89Å
457	S	91.9	Very high	84.4	Confident	85 Å²	85	51.9 Å²	51.9	59%	0.594	30%	0.298	S	S	*	.	H	α-helix	trans	-61.6	-52.4	176.9	-171.6	0	0	0	0	111.5	T455 F459 N460 A461	T455-S457 PolarHBondContact O-N 3.39Å; S457-F459 VanDerWaalsContact C-N 3.31Å; S457-F459 PolarHBondContact O-N 2.94Å; S457-N460 PolarHBondContact O-N 3.27Å; S457-A461 VanDerWaalsContact O-CB 3.23Å; S457-A461 WeakPolarHBondContact O-CB 3.38Å; S457-A461 PolarHBondContact O-N 3.4Å
458	D	91.1	Very high	84.4	Confident	64 Å²	64	52.3 Å²	52.3	34%	0.342	31%	0.309	S	S	.	.	H	α-helix	trans	-62.6	-40.8	-179.6	-63.4	-33.4	0	0	0	111.4	W433 T455 G462	W433-D458 HydrophobicContact CE3-CB 4.45Å; T455-D458 PolarHBondContact O-N 3.04Å; T455-D458 WeakPolarHBondContact OG1-CB 3.42Å; T455-D458 PolarHBondContact OG1-N 2.86Å; T455-D458 PolarHBondContact OG1-OD2 3.2Å; D458-G462 WeakPolarHBondContact O-CA 3.44Å; D458-G462 PolarHBondContact O-N 2.9Å
459	F	92.8	Very high	84.6	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-57.3	-54.4	173.3	166.9	-101.2	0	0	0	112.8	V305 V309 V327 I331 C359 L361 T455 F456 S457 G462 A463	V305-F459 HydrophobicContact CG1-CE2 3.85Å; V305-F459 HydrophobicContact CG1-CZ 3.62Å; V309-F459 HydrophobicContact CG1-CE1 4.14Å; V309-F459 HydrophobicContact CG1-CZ 4.01Å; V327-F459 HydrophobicContact CG1-CB 3.66Å; V327-F459 HydrophobicContact CG1-CD2 4.45Å; V327-F459 HydrophobicContact CG1-CG 3.97Å; V327-F459 HydrophobicContact CG2-CD1 4.39Å; V327-F459 HydrophobicContact CG2-CG 4.47Å; I331-F459 HydrophobicContact CD1-CE2 4.34Å; I331-F459 HydrophobicContact CD1-CZ 4.02Å; C359-F459 HydrophobicContact CB-CE2 4.01Å; C359-F459 WeakPolarHBondContact O-CD2 3.26Å; L361-F459 HydrophobicContact CD1-CD2 3.95Å; L361-F459 HydrophobicContact CD1-CE2 3.46Å; L361-F459 VanDerWaalsContact CD1-CE2 3.46Å; L361-F459 HydrophobicContact CD1-CZ 3.93Å; L361-F459 HydrophobicContact CD2-CD2 4.44Å; L361-F459 HydrophobicContact CG-CD2 4.04Å; L361-F459 HydrophobicContact CG-CE2 3.84Å; T455-F459 WeakPolarHBondContact O-CB 3.39Å; T455-F459 PolarHBondContact O-N 3.46Å; F456-F459 HydrophobicContact CD2-CD1 4.45Å; S457-F459 VanDerWaalsContact C-N 3.31Å; S457-F459 PolarHBondContact O-N 2.94Å; F459-G462 PolarHBondContact O-N 3.41Å; F459-A463 VanDerWaalsContact O-CB 3.31Å; F459-A463 WeakPolarHBondContact O-CB 3.31Å; F459-A463 PolarHBondContact O-N 3.14Å; F459-A463 VanDerWaalsContact O-N 3.1Å
460	N	92.4	Very high	84.8	Confident	22 Å²	22	54.5 Å²	54.5	12%	0.118	32%	0.321	C	S	.	.	H	α-helix	trans	-72.3	-38.6	-172.8	-154	23.2	0	0	0	111	K302 H304 F456 S457 A463	K302-N460 PolarHBondContact O-ND2 2.67Å; H304-N460 PolarHBondContact N-OD1 2.98Å; H304-N460 PolarHBondContact ND1-O 3.1Å; H304-N460 PolarHBondContact ND1-OD1 2.82Å; F456-N460 HydrophobicContact CE1-CB 4.47Å; F456-N460 HydrophobicContact CZ-CB 4.44Å; F456-N460 WeakPolarHBondContact O-CB 3.49Å; F456-N460 PolarHBondContact O-N 2.89Å; S457-N460 PolarHBondContact O-N 3.27Å; N460-A463 PolarHBondContact O-N 3.11Å
461	A	88.4	Confident	85	Confident	54 Å²	54	57.9 Å²	57.9	45%	0.446	34%	0.343	S	S	.	.	H	α-helix	trans	-65	-45.4	174.2	0	0	0	0	0	111.6	S457 A463 I464	S457-A461 VanDerWaalsContact O-CB 3.23Å; S457-A461 WeakPolarHBondContact O-CB 3.38Å; S457-A461 PolarHBondContact O-N 3.4Å; A461-A463 PolarHBondContact O-N 3.11Å; A461-A463 VanDerWaalsContact O-N 3.14Å; A461-I464 WeakPolarHBondContact O-CB 3.43Å; A461-I464 WeakPolarHBondContact O-CD1 3.38Å; A461-I464 VanDerWaalsContact O-CG1 3.28Å; A461-I464 WeakPolarHBondContact O-CG1 3.49Å; A461-I464 PolarHBondContact O-N 3.49Å
462	G	83.4	Confident	85.1	Confident	19 Å²	19	61 Å²	61	20%	0.196	35%	0.349	C	S	.	.	H	α-helix	trans	-64.6	-14.6	176.9	0	0	0	0	0	114.2	D458 F459 K467	D458-G462 WeakPolarHBondContact O-CA 3.44Å; D458-G462 PolarHBondContact O-N 2.9Å; F459-G462 PolarHBondContact O-N 3.41Å; G462-K467 WeakPolarHBondContact O-CE 3.14Å; G462-K467 PolarHBondContact O-NZ 3.23Å
463	A	84.1	Confident	84.9	Confident	7 Å²	7	62.8 Å²	62.8	6%	0.058	35%	0.351	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.7	-3.3	178.9	0	0	0	0	0	114.9	H304 V305 R355 F459 N460 A461 K465	H304-A463 HydrophobicContact CB-CB 3.82Å; V305-A463 HydrophobicContact CB-CB 3.88Å; V305-A463 HydrophobicContact CG1-CB 3.31Å; R355-A463 PolarHBondContact NH2-O 3.28Å; F459-A463 VanDerWaalsContact O-CB 3.31Å; F459-A463 WeakPolarHBondContact O-CB 3.31Å; F459-A463 PolarHBondContact O-N 3.14Å; F459-A463 VanDerWaalsContact O-N 3.1Å; N460-A463 PolarHBondContact O-N 3.11Å; A461-A463 PolarHBondContact O-N 3.11Å; A461-A463 VanDerWaalsContact O-N 3.14Å; A463-K465 PolarHBondContact O-N 3.36Å
464	I	82.9	Confident	84.7	Confident	72 Å²	72	65 Å²	65	37%	0.369	36%	0.364	S	S	.	.			trans	-58.2	133.5	179.9	-67	169.6	0	0	0	110.2	H304 A461 N466 K467	H304-I464 VanDerWaalsContact CE1-CG1 3.48Å; H304-I464 WeakPolarHBondContact CE1-CG1 3.44Å; H304-I464 VanDerWaalsContact ND1-CG1 3.29Å; H304-I464 WeakPolarHBondContact ND1-CG1 3.47Å; A461-I464 WeakPolarHBondContact O-CB 3.43Å; A461-I464 WeakPolarHBondContact O-CD1 3.38Å; A461-I464 VanDerWaalsContact O-CG1 3.28Å; A461-I464 WeakPolarHBondContact O-CG1 3.49Å; A461-I464 PolarHBondContact O-N 3.49Å; I464-N466 PolarHBondContact O-N 3.5Å; I464-K467 WeakPolarHBondContact O-CG 3.28Å
465	K	66.5	Low	84.8	Confident	136 Å²	136	64.8 Å²	64.8	59%	0.591	36%	0.363	S	S	*	.	S	Bend	trans	-59.8	-31.7	-175.7	-74.5	-172.1	176.1	-172	0	113.5	R355 A463 K467	R355-K465 VanDerWaalsContact CZ-CG 3.5Å; A463-K465 PolarHBondContact O-N 3.36Å; K465-K467 PolarHBondContact O-N 3.17Å
466	N	66.3	Low	84.7	Confident	145 Å²	145	64.5 Å²	64.5	78%	0.775	36%	0.364	S	S	*	.	S	Bend	trans	-97.4	64.9	-177.7	-62.3	-16.7	0	0	0	110.2	I464	I464-N466 PolarHBondContact O-N 3.5Å
467	K	67.8	Low	84.3	Confident	103 Å²	103	68.3 Å²	68.3	45%	0.448	38%	0.377	S	S	.	.	P	Polyproline II helix	trans	-64	150.1	169.6	-60.6	-168.1	179.2	-160	0	109.6	G462 I464 K465 Q469	G462-K467 WeakPolarHBondContact O-CE 3.14Å; G462-K467 PolarHBondContact O-NZ 3.23Å; I464-K467 WeakPolarHBondContact O-CG 3.28Å; K465-K467 PolarHBondContact O-N 3.17Å; K467-Q469 WeakPolarHBondContact O-CG 3.39Å; K467-Q469 PolarHBondContact O-N 2.79Å
468	A	69	Low	84.4	Confident	105 Å²	105	68.6 Å²	68.6	87%	0.868	37%	0.369	S	S	*	.	P	Polyproline II helix	trans	-52.1	127.4	165.5	0	0	0	0	0	108.7
469	Q	76.8	Confident	84.5	Confident	105 Å²	105	65.6 Å²	65.6	49%	0.491	35%	0.353	S	S	.	.	P	Polyproline II helix	trans	-102.4	132.6	-177.4	-65.7	172.6	-11.3	0	0	108	K467 V474	K467-Q469 WeakPolarHBondContact O-CG 3.39Å; K467-Q469 PolarHBondContact O-N 2.79Å; Q469-V474 HydrophobicContact CB-CG2 3.8Å
470	S	85.4	Confident	84.5	Confident	52 Å²	52	69.8 Å²	69.8	36%	0.364	37%	0.374	S	S	.	.	P	Polyproline II helix	trans	-73.4	150.7	172.3	69.6	0	0	0	0	110.3	R472 E473 V474	S470-R472 PolarHBondContact O-N 3.26Å; S470-E473 PolarHBondContact N-OE2 2.7Å; S470-E473 PolarHBondContact O-N 3.12Å; S470-E473 WeakPolarHBondContact OG-CB 3.3Å; S470-E473 VanDerWaalsContact OG-CG 3.27Å; S470-E473 WeakPolarHBondContact OG-CG 3.25Å; S470-E473 PolarHBondContact OG-N 3.13Å; S470-E473 VanDerWaalsContact OG-N 3.12Å; S470-V474 WeakPolarHBondContact O-CG2 3.33Å; S470-V474 PolarHBondContact O-N 3.31Å
471	V	91.8	Very high	84.5	Confident	94 Å²	94	76.3 Å²	76.3	57%	0.57	40%	0.403	S	S	*	.	H	α-helix	trans	-52.5	-39.8	172.8	176.8	0	0	0	0	110.4	E473 V474 F475 T499	V471-E473 PolarHBondContact O-N 3.21Å; V471-V474 PolarHBondContact O-N 3.03Å; V471-F475 VanDerWaalsContact O-CB 3.25Å; V471-F475 WeakPolarHBondContact O-CB 3.14Å; V471-F475 PolarHBondContact O-N 3.05Å; V471-T499 HydrophobicContact CG1-CG2 3.9Å
472	R	91.3	Very high	84.7	Confident	106 Å²	106	74.9 Å²	74.9	40%	0.4	39%	0.389	S	S	.	.	H	α-helix	trans	-57.5	-46.6	175.8	-169.7	-178.9	162.5	102.7	1.1	112.6	S470 F475 A476 V494 D495	S470-R472 PolarHBondContact O-N 3.26Å; R472-F475 PolarHBondContact O-N 3.22Å; R472-A476 PolarHBondContact O-N 2.94Å; R472-V494 HydrophobicContact CB-CG1 4.41Å; R472-V494 HydrophobicContact CG-CG1 3.21Å; R472-V494 PolarHBondContact NH1-O 3.4Å; R472-V494 VanDerWaalsContact NH1-O 3.12Å; R472-D495 IonicContact CZ-OD1 3.36Å; R472-D495 IonicContact NH1-OD1 2.65Å; R472-D495 IonicContact NH2-OD1 3.06Å; R472-D495 PolarHBondContact NH2-OD1 2.99Å
473	E	86.9	Confident	85	Confident	91 Å²	91	85.6 Å²	85.6	43%	0.425	42%	0.424	S	S	.	.	H	α-helix	trans	-70.8	-38.1	178.6	-75.7	175.9	168.4	0	0	113.2	S470 V471 F475 R477	S470-E473 PolarHBondContact N-OE2 2.7Å; S470-E473 PolarHBondContact O-N 3.12Å; S470-E473 WeakPolarHBondContact OG-CB 3.3Å; S470-E473 VanDerWaalsContact OG-CG 3.27Å; S470-E473 WeakPolarHBondContact OG-CG 3.25Å; S470-E473 PolarHBondContact OG-N 3.13Å; S470-E473 VanDerWaalsContact OG-N 3.12Å; V471-E473 PolarHBondContact O-N 3.21Å; E473-F475 VanDerWaalsContact C-N 3.34Å; E473-R477 WeakPolarHBondContact O-CG 3.46Å; E473-R477 PolarHBondContact O-N 3.24Å; E473-R477 PolarHBondContact O-NE 3.2Å; E473-R477 VanDerWaalsContact O-NE 3.15Å
474	V	89.5	Confident	85.2	Confident	46 Å²	46	87.5 Å²	87.5	28%	0.279	44%	0.444	S	S	.	.	H	α-helix	trans	-62.9	-46.1	173.5	178.4	0	0	0	0	109.6	Q469 S470 V471 A476 R477 Q478	Q469-V474 HydrophobicContact CB-CG2 3.8Å; S470-V474 WeakPolarHBondContact O-CG2 3.33Å; S470-V474 PolarHBondContact O-N 3.31Å; V471-V474 PolarHBondContact O-N 3.03Å; V474-A476 PolarHBondContact O-N 3.48Å; V474-R477 VanDerWaalsContact CG2-NH2 3.28Å; V474-R477 PolarHBondContact O-N 3.46Å; V474-R477 VanDerWaalsContact O-N 3.14Å; V474-Q478 HydrophobicContact CG1-CG 4.39Å; V474-Q478 WeakPolarHBondContact O-CG 3.32Å; V474-Q478 PolarHBondContact O-N 3.26Å
475	F	94.8	Very high	85.6	Confident	2 Å²	2	84.5 Å²	84.5	1%	0.009	43%	0.429	C	S	.	.	H	α-helix	trans	-61.9	-45.2	-179.9	-177	-147.9	0	0	0	112.6	V471 R472 E473 R477 Q478 L479 V494 Y497 T499 P500 L503 Y544	V471-F475 VanDerWaalsContact O-CB 3.25Å; V471-F475 WeakPolarHBondContact O-CB 3.14Å; V471-F475 PolarHBondContact O-N 3.05Å; R472-F475 PolarHBondContact O-N 3.22Å; E473-F475 VanDerWaalsContact C-N 3.34Å; F475-R477 VanDerWaalsContact C-N 3.26Å; F475-R477 PolarHBondContact O-N 3.49Å; F475-Q478 WeakPolarHBondContact O-CB 3.44Å; F475-Q478 PolarHBondContact O-N 3.14Å; F475-Q478 VanDerWaalsContact O-N 3.12Å; F475-L479 HydrophobicContact CD2-CD1 4.24Å; F475-L479 HydrophobicContact CD2-CG 4.02Å; F475-L479 HydrophobicContact CE1-CD1 4.26Å; F475-L479 HydrophobicContact CE2-CD1 3.92Å; F475-L479 HydrophobicContact CE2-CD2 3.79Å; F475-L479 HydrophobicContact CE2-CG 3.71Å; F475-L479 HydrophobicContact CZ-CD1 3.94Å; F475-L479 HydrophobicContact CZ-CD2 4.18Å; F475-L479 HydrophobicContact CZ-CG 4.2Å; F475-L479 WeakPolarHBondContact O-CG 3.27Å; F475-L479 PolarHBondContact O-N 2.85Å; F475-V494 HydrophobicContact CD1-CG2 3.79Å; F475-V494 HydrophobicContact CE1-CG2 4.19Å; F475-V494 HydrophobicContact CG-CG2 4.37Å; F475-Y497 VanDerWaalsContact CE1-O 3.26Å; F475-Y497 WeakPolarHBondContact CE1-O 3.41Å; F475-T499 VanDerWaalsContact CE1-C 3.5Å; F475-T499 WeakPolarHBondContact CE1-O 3.4Å; F475-P500 HydrophobicContact CB-CG 4.07Å; F475-P500 HydrophobicContact CD1-CG 4.42Å; F475-P500 HydrophobicContact CD2-CB 4.29Å; F475-P500 HydrophobicContact CD2-CG 3.65Å; F475-P500 HydrophobicContact CE2-CB 4.32Å; F475-P500 HydrophobicContact CE2-CG 4.17Å; F475-P500 HydrophobicContact CG-CG 3.8Å; F475-L503 HydrophobicContact CE2-CD2 4.43Å; F475-L503 HydrophobicContact CZ-CB 4.12Å; F475-L503 HydrophobicContact CZ-CD2 3.8Å; F475-Y544 WeakPolarHBondContact CE2-OH 3.38Å
476	A	91.5	Very high	86.7	Confident	23 Å²	23	80.6 Å²	80.6	19%	0.19	42%	0.419	C	S	.	.	H	α-helix	trans	-55.6	-41.3	174.3	0	0	0	0	0	112.4	R472 V474 L479 M480 A490 V494	R472-A476 PolarHBondContact O-N 2.94Å; V474-A476 PolarHBondContact O-N 3.48Å; A476-L479 PolarHBondContact O-N 3.2Å; A476-M480 VanDerWaalsContact O-CG 3.3Å; A476-M480 WeakPolarHBondContact O-CG 3.41Å; A476-M480 PolarHBondContact O-N 2.95Å; A476-M480 VanDerWaalsContact O-N 3.15Å; A476-A490 HydrophobicContact CB-CB 4.49Å; A476-V494 HydrophobicContact CB-CG2 4.05Å
477	R	87.1	Confident	87.8	Confident	104 Å²	104	75.6 Å²	75.6	39%	0.392	40%	0.402	S	S	.	.	H	α-helix	trans	-71.4	-33.7	178.1	-73.9	178.9	-66.8	162.4	5.2	113.3	E473 V474 F475 M480 Q481	E473-R477 WeakPolarHBondContact O-CG 3.46Å; E473-R477 PolarHBondContact O-N 3.24Å; E473-R477 PolarHBondContact O-NE 3.2Å; E473-R477 VanDerWaalsContact O-NE 3.15Å; V474-R477 VanDerWaalsContact CG2-NH2 3.28Å; V474-R477 PolarHBondContact O-N 3.46Å; V474-R477 VanDerWaalsContact O-N 3.14Å; F475-R477 VanDerWaalsContact C-N 3.26Å; F475-R477 PolarHBondContact O-N 3.49Å; R477-M480 PolarHBondContact O-N 2.99Å; R477-Q481 PolarHBondContact O-NE2 3.39Å
478	Q	92.2	Very high	88.9	Confident	90 Å²	90	76.3 Å²	76.3	42%	0.421	41%	0.406	S	S	.	.	H	α-helix	trans	-63	-47.6	172.4	-71.3	168.9	-18.5	0	0	110.4	V474 F475 M480 Q481	V474-Q478 HydrophobicContact CG1-CG 4.39Å; V474-Q478 WeakPolarHBondContact O-CG 3.32Å; V474-Q478 PolarHBondContact O-N 3.26Å; F475-Q478 WeakPolarHBondContact O-CB 3.44Å; F475-Q478 PolarHBondContact O-N 3.14Å; F475-Q478 VanDerWaalsContact O-N 3.12Å; Q478-M480 VanDerWaalsContact C-N 3.28Å; Q478-M480 PolarHBondContact O-N 3.27Å; Q478-Q481 VanDerWaalsContact O-CB 3.28Å; Q478-Q481 WeakPolarHBondContact O-CB 3.32Å; Q478-Q481 WeakPolarHBondContact O-CG 3.44Å; Q478-Q481 PolarHBondContact O-N 3.06Å
479	L	93.8	Very high	90	Very high	1 Å²	1	73.9 Å²	73.9	1%	0.005	38%	0.376	C	S	.	.	H	α-helix	trans	-58.4	-40	177.2	-69.8	171.9	0	0	0	112.2	F475 A476 Q481 V482 V485 A490 L493 V494 L540 Y544	F475-L479 HydrophobicContact CD2-CD1 4.24Å; F475-L479 HydrophobicContact CD2-CG 4.02Å; F475-L479 HydrophobicContact CE1-CD1 4.26Å; F475-L479 HydrophobicContact CE2-CD1 3.92Å; F475-L479 HydrophobicContact CE2-CD2 3.79Å; F475-L479 HydrophobicContact CE2-CG 3.71Å; F475-L479 HydrophobicContact CZ-CD1 3.94Å; F475-L479 HydrophobicContact CZ-CD2 4.18Å; F475-L479 HydrophobicContact CZ-CG 4.2Å; F475-L479 WeakPolarHBondContact O-CG 3.27Å; F475-L479 PolarHBondContact O-N 2.85Å; A476-L479 PolarHBondContact O-N 3.2Å; L479-Q481 PolarHBondContact O-N 2.93Å; L479-Q481 VanDerWaalsContact O-N 3.17Å; L479-V482 PolarHBondContact O-N 3.4Å; L479-V482 VanDerWaalsContact O-N 3.09Å; L479-V485 HydrophobicContact CB-CG1 4.23Å; L479-V485 WeakPolarHBondContact O-CB 3.44Å; L479-A490 HydrophobicContact CB-CB 4.3Å; L479-L493 HydrophobicContact CD1-CB 3.82Å; L479-L493 HydrophobicContact CD1-CD1 4.06Å; L479-L493 HydrophobicContact CD2-CD1 4.36Å; L479-V494 HydrophobicContact CD1-CG2 3.73Å; L479-L540 HydrophobicContact CD2-CD2 3.94Å; L479-Y544 HydrophobicContact CD2-CE2 4.33Å
480	M	92.5	Very high	90.8	Very high	89 Å²	89	68.9 Å²	68.9	44%	0.438	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-9.5	177.5	-70.5	175.7	63.4	0	0	114.5	A476 R477 Q478 A490	A476-M480 VanDerWaalsContact O-CG 3.3Å; A476-M480 WeakPolarHBondContact O-CG 3.41Å; A476-M480 PolarHBondContact O-N 2.95Å; A476-M480 VanDerWaalsContact O-N 3.15Å; R477-M480 PolarHBondContact O-N 2.99Å; Q478-M480 VanDerWaalsContact C-N 3.28Å; Q478-M480 PolarHBondContact O-N 3.27Å; M480-A490 HydrophobicContact CG-CB 3.7Å; M480-A490 HydrophobicContact SD-CB 4.33Å
481	Q	92.8	Very high	91.1	Very high	158 Å²	158	68.6 Å²	68.6	74%	0.738	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.5	-21.8	171.1	-57.7	-49.6	-59.3	0	0	111.9	R477 Q478 L479 R483	R477-Q481 PolarHBondContact O-NE2 3.39Å; Q478-Q481 VanDerWaalsContact O-CB 3.28Å; Q478-Q481 WeakPolarHBondContact O-CB 3.32Å; Q478-Q481 WeakPolarHBondContact O-CG 3.44Å; Q478-Q481 PolarHBondContact O-N 3.06Å; L479-Q481 PolarHBondContact O-N 2.93Å; L479-Q481 VanDerWaalsContact O-N 3.17Å; Q481-R483 PolarHBondContact O-N 3.42Å
482	V	92.4	Very high	91.3	Very high	25 Å²	25	64.7 Å²	64.7	15%	0.152	33%	0.331	C	S	.	.	S	Bend	trans	-78.7	121.2	176.4	-177.1	0	0	0	0	109.6	L479 G484 V485 T539 L540 L543	L479-V482 PolarHBondContact O-N 3.4Å; L479-V482 VanDerWaalsContact O-N 3.09Å; V482-G484 PolarHBondContact O-N 3.37Å; V482-V485 HydrophobicContact CB-CG2 3.93Å; V482-V485 HydrophobicContact CG1-CG2 4.18Å; V482-V485 WeakPolarHBondContact O-CB 3.13Å; V482-V485 PolarHBondContact O-N 3.1Å; V482-T539 HydrophobicContact CG1-CG2 3.77Å; V482-L540 HydrophobicContact CG2-CD2 4.02Å; V482-L543 HydrophobicContact CG2-CD2 4.01Å
483	R	88.9	Confident	91.4	Very high	243 Å²	243	59.8 Å²	59.8	92%	0.917	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	123.4	-179.2	-173.9	178.8	178.5	-174.3	-2.1	110.5	Q481	Q481-R483 PolarHBondContact O-N 3.42Å
484	G	88.8	Confident	91.9	Very high	47 Å²	47	55.5 Å²	55.5	49%	0.485	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	101.3	-7.5	-179.8	0	0	0	0	0	114.5	V482 K489	V482-G484 PolarHBondContact O-N 3.37Å; G484-K489 VanDerWaalsContact O-CD 3.25Å; G484-K489 WeakPolarHBondContact O-CD 3.43Å; G484-K489 PolarHBondContact O-NZ 2.71Å; G484-K489 VanDerWaalsContact O-NZ 3.11Å
485	V	92.1	Very high	92.1	Very high	9 Å²	9	58.6 Å²	58.6	6%	0.055	31%	0.308	C	S	.	.			trans	-90.4	100.6	168.3	-175	0	0	0	0	109.1	L479 V482 K489 A490 L493 L536	L479-V485 HydrophobicContact CB-CG1 4.23Å; L479-V485 WeakPolarHBondContact O-CB 3.44Å; V482-V485 HydrophobicContact CB-CG2 3.93Å; V482-V485 HydrophobicContact CG1-CG2 4.18Å; V482-V485 WeakPolarHBondContact O-CB 3.13Å; V482-V485 PolarHBondContact O-N 3.1Å; V485-K489 HydrophobicContact CG1-CB 4.11Å; V485-A490 HydrophobicContact CG1-CB 4.08Å; V485-L493 HydrophobicContact CG1-CD1 4.44Å; V485-L536 HydrophobicContact CG2-CD2 4.26Å
486	S	90	Very high	92.1	Very high	55 Å²	55	65.6 Å²	65.6	39%	0.385	34%	0.335	S	S	.	.			trans	-80.5	169.8	172.6	62.7	0	0	0	0	111.1	E488 K489 A490	S486-E488 PolarHBondContact O-N 3.49Å; S486-K489 PolarHBondContact O-N 3Å; S486-A490 PolarHBondContact O-N 3Å
487	G	88.4	Confident	92.3	Very high	39 Å²	39	65.2 Å²	65.2	40%	0.402	33%	0.328	S	S	.	.	H	α-helix	trans	-55.7	-37.1	175.1	0	0	0	0	0	113.5	K489 A490 A491	G487-K489 VanDerWaalsContact C-N 3.34Å; G487-K489 PolarHBondContact O-N 2.75Å; G487-A490 PolarHBondContact O-N 3.37Å; G487-A491 WeakPolarHBondContact O-CB 3.5Å; G487-A491 PolarHBondContact O-N 3.21Å
488	E	90.4	Very high	92.6	Very high	118 Å²	118	62.9 Å²	62.9	55%	0.551	33%	0.328	S	S	*	.	H	α-helix	trans	-65.7	-36.1	175.7	-64	-176.3	163.8	0	0	112.8	S486 A492	S486-E488 PolarHBondContact O-N 3.49Å; E488-A492 PolarHBondContact O-N 3.31Å
489	K	93.5	Very high	92.8	Very high	54 Å²	54	60.6 Å²	60.6	24%	0.235	32%	0.32	C	S	.	.	H	α-helix	trans	-74.4	-41.4	176.9	-68.1	178.7	172.7	-166.1	0	111.4	G484 V485 S486 G487 A491 A492 L493 C525 L532 L536	G484-K489 VanDerWaalsContact O-CD 3.25Å; G484-K489 WeakPolarHBondContact O-CD 3.43Å; G484-K489 PolarHBondContact O-NZ 2.71Å; G484-K489 VanDerWaalsContact O-NZ 3.11Å; V485-K489 HydrophobicContact CG1-CB 4.11Å; S486-K489 PolarHBondContact O-N 3Å; G487-K489 VanDerWaalsContact C-N 3.34Å; G487-K489 PolarHBondContact O-N 2.75Å; K489-A491 VanDerWaalsContact C-N 3.34Å; K489-A492 PolarHBondContact O-N 2.83Å; K489-L493 WeakPolarHBondContact O-CG 3.3Å; K489-L493 PolarHBondContact O-N 3.01Å; K489-C525 HydrophobicContact CG-CB 3.94Å; K489-L532 HydrophobicContact CB-CD1 4.01Å; K489-L532 HydrophobicContact CD-CD1 3.87Å; K489-L532 HydrophobicContact CG-CD1 4.05Å; K489-L536 HydrophobicContact CD-CD1 4.06Å
490	A	93.6	Very high	92.9	Very high	1 Å²	1	62.1 Å²	62.1	1%	0.008	33%	0.33	C	S	.	.	H	α-helix	trans	-62.3	-42.2	174.7	0	0	0	0	0	111.3	A476 L479 M480 V485 S486 G487 L493 V494	A476-A490 HydrophobicContact CB-CB 4.49Å; L479-A490 HydrophobicContact CB-CB 4.3Å; M480-A490 HydrophobicContact CG-CB 3.7Å; M480-A490 HydrophobicContact SD-CB 4.33Å; V485-A490 HydrophobicContact CG1-CB 4.08Å; S486-A490 PolarHBondContact O-N 3Å; G487-A490 PolarHBondContact O-N 3.37Å; A490-L493 PolarHBondContact O-N 3Å; A490-V494 WeakPolarHBondContact O-CB 3.5Å; A490-V494 WeakPolarHBondContact O-CG2 3.27Å; A490-V494 PolarHBondContact O-N 2.99Å
491	A	92	Very high	93.1	Very high	45 Å²	45	61.1 Å²	61.1	37%	0.372	34%	0.336	S	S	.	.	H	α-helix	trans	-58.8	-49.7	174.3	0	0	0	0	0	111.5	G487 K489 L493 V494 D495	G487-A491 WeakPolarHBondContact O-CB 3.5Å; G487-A491 PolarHBondContact O-N 3.21Å; K489-A491 VanDerWaalsContact C-N 3.34Å; A491-L493 VanDerWaalsContact C-N 3.32Å; A491-L493 PolarHBondContact O-N 3.28Å; A491-V494 CarbonylContact O-C 3.37Å; A491-V494 PolarHBondContact O-N 3.36Å; A491-V494 VanDerWaalsContact O-N 3.16Å; A491-D495 WeakPolarHBondContact O-CB 3.38Å; A491-D495 PolarHBondContact O-N 3.47Å
492	A	94.3	Very high	93.3	Very high	12 Å²	12	55.6 Å²	55.6	10%	0.099	32%	0.315	C	S	.	.	H	α-helix	trans	-60.6	-38.3	178	0	0	0	0	0	113.7	E488 K489 R496 I523 K524 C525	E488-A492 PolarHBondContact O-N 3.31Å; K489-A492 PolarHBondContact O-N 2.83Å; A492-R496 PolarHBondContact O-N 3.12Å; A492-I523 HydrophobicContact CB-CG2 3.95Å; A492-K524 VanDerWaalsContact CB-O 3.23Å; A492-K524 WeakPolarHBondContact CB-O 3.37Å; A492-C525 HydrophobicContact CB-CB 4.27Å
493	L	94.9	Very high	93.5	Very high	3 Å²	3	54.5 Å²	54.5	2%	0.016	31%	0.308	C	S	.	.	H	α-helix	trans	-64.5	-46.3	174.4	-78.9	164.3	0	0	0	111.5	L479 V485 K489 A490 A491 D495 R496 Y497 L520 I523 L532 L540	L479-L493 HydrophobicContact CD1-CB 3.82Å; L479-L493 HydrophobicContact CD1-CD1 4.06Å; L479-L493 HydrophobicContact CD2-CD1 4.36Å; V485-L493 HydrophobicContact CG1-CD1 4.44Å; K489-L493 WeakPolarHBondContact O-CG 3.3Å; K489-L493 PolarHBondContact O-N 3.01Å; A490-L493 PolarHBondContact O-N 3Å; A491-L493 VanDerWaalsContact C-N 3.32Å; A491-L493 PolarHBondContact O-N 3.28Å; L493-D495 VanDerWaalsContact C-N 3.31Å; L493-D495 PolarHBondContact O-N 3.37Å; L493-R496 PolarHBondContact O-N 2.96Å; L493-Y497 PolarHBondContact O-N 3.48Å; L493-L520 HydrophobicContact CD2-CB 4.28Å; L493-L520 HydrophobicContact CD2-CD1 3.85Å; L493-L520 HydrophobicContact CD2-CD2 4.07Å; L493-L520 HydrophobicContact CD2-CG 4.3Å; L493-I523 HydrophobicContact CD2-CD1 3.64Å; L493-L532 HydrophobicContact CD1-CD2 4.35Å; L493-L532 HydrophobicContact CD2-CD2 3.99Å; L493-L532 HydrophobicContact CG-CD2 4.39Å; L493-L540 HydrophobicContact CD1-CD1 3.83Å; L493-L540 HydrophobicContact CD2-CD1 4.4Å
494	V	95.7	Very high	93.9	Very high	2 Å²	2	45.9 Å²	45.9	1%	0.012	28%	0.28	C	S	.	.	H	α-helix	trans	-73.9	-23.6	-177.4	176.8	0	0	0	0	112.5	R472 F475 A476 L479 A490 A491 R496 Y497 S498	R472-V494 HydrophobicContact CB-CG1 4.41Å; R472-V494 HydrophobicContact CG-CG1 3.21Å; R472-V494 PolarHBondContact NH1-O 3.4Å; R472-V494 VanDerWaalsContact NH1-O 3.12Å; F475-V494 HydrophobicContact CD1-CG2 3.79Å; F475-V494 HydrophobicContact CE1-CG2 4.19Å; F475-V494 HydrophobicContact CG-CG2 4.37Å; A476-V494 HydrophobicContact CB-CG2 4.05Å; L479-V494 HydrophobicContact CD1-CG2 3.73Å; A490-V494 WeakPolarHBondContact O-CB 3.5Å; A490-V494 WeakPolarHBondContact O-CG2 3.27Å; A490-V494 PolarHBondContact O-N 2.99Å; A491-V494 CarbonylContact O-C 3.37Å; A491-V494 PolarHBondContact O-N 3.36Å; A491-V494 VanDerWaalsContact O-N 3.16Å; V494-R496 VanDerWaalsContact C-N 3.34Å; V494-Y497 VanDerWaalsContact CA-O 3.3Å; V494-Y497 WeakPolarHBondContact CA-O 3.23Å; V494-Y497 CarbonylContact O-C 3.59Å; V494-S498 VanDerWaalsContact O-CA 3.27Å; V494-S498 WeakPolarHBondContact O-CA 3.32Å; V494-S498 PolarHBondContact O-N 3.42Å
495	D	94	Very high	94.3	Very high	110 Å²	110	46.3 Å²	46.3	59%	0.588	28%	0.279	S	S	*	.	H	α-helix	trans	-65.5	-38.3	169.4	-74.2	-22.1	0	0	0	111.6	R472 A491 L493	R472-D495 IonicContact CZ-OD1 3.36Å; R472-D495 IonicContact NH1-OD1 2.65Å; R472-D495 IonicContact NH2-OD1 3.06Å; R472-D495 PolarHBondContact NH2-OD1 2.99Å; A491-D495 WeakPolarHBondContact O-CB 3.38Å; A491-D495 PolarHBondContact O-N 3.47Å; L493-D495 VanDerWaalsContact C-N 3.31Å; L493-D495 PolarHBondContact O-N 3.37Å
496	R	94.8	Very high	94.4	Very high	150 Å²	150	46.9 Å²	46.9	57%	0.566	28%	0.284	S	S	*	.	H	α-helix	trans	-83.6	-36	177.9	-177.5	58.6	-175.4	80.7	-0.3	113.4	A492 L493 V494 I523	A492-R496 PolarHBondContact O-N 3.12Å; L493-R496 PolarHBondContact O-N 2.96Å; V494-R496 VanDerWaalsContact C-N 3.34Å; R496-I523 HydrophobicContact CB-CD1 4.47Å
497	Y	96.4	Very high	94.8	Very high	14 Å²	14	44.3 Å²	44.3	6%	0.055	27%	0.266	C	S	.	.			trans	-132	96.7	-179.4	-57.5	-71.5	0	0	0	108.7	F475 L493 V494 T499 L503 A506 L520 I523	F475-Y497 VanDerWaalsContact CE1-O 3.26Å; F475-Y497 WeakPolarHBondContact CE1-O 3.41Å; L493-Y497 PolarHBondContact O-N 3.48Å; V494-Y497 VanDerWaalsContact CA-O 3.3Å; V494-Y497 WeakPolarHBondContact CA-O 3.23Å; V494-Y497 CarbonylContact O-C 3.59Å; Y497-T499 PolarHBondContact O-N 3.26Å; Y497-L503 HydrophobicContact CD2-CD1 3.84Å; Y497-L503 HydrophobicContact CE2-CD1 4.11Å; Y497-L503 HydrophobicContact CG-CB 4.3Å; Y497-L503 HydrophobicContact CG-CD1 4.12Å; Y497-A506 HydrophobicContact CD1-CB 4.17Å; Y497-A506 HydrophobicContact CE1-CB 3.43Å; Y497-A506 VanDerWaalsContact CE1-CB 3.43Å; Y497-L520 HydrophobicContact CD2-CD2 4.05Å; Y497-L520 HydrophobicContact CE2-CD2 3.51Å; Y497-I523 HydrophobicContact CE2-CD1 4.21Å
498	S	93.3	Very high	95.1	Very high	55 Å²	55	48 Å²	48	39%	0.385	28%	0.277	S	S	.	.			trans	-70.3	-16.6	-168.7	58.7	0	0	0	0	114.6	V494	V494-S498 VanDerWaalsContact O-CA 3.27Å; V494-S498 WeakPolarHBondContact O-CA 3.32Å; V494-S498 PolarHBondContact O-N 3.42Å
499	T	95.9	Very high	95.3	Very high	43 Å²	43	46.4 Å²	46.4	26%	0.264	28%	0.284	S	S	.	.	S	Bend	trans	-141.6	159.6	-177.6	68.9	0	0	0	0	111.4	V471 F475 Y497 A501 S502 L503	V471-T499 HydrophobicContact CG1-CG2 3.9Å; F475-T499 VanDerWaalsContact CE1-C 3.5Å; F475-T499 WeakPolarHBondContact CE1-O 3.4Å; Y497-T499 PolarHBondContact O-N 3.26Å; T499-A501 VanDerWaalsContact C-N 3.26Å; T499-A501 PolarHBondContact O-N 3.03Å; T499-S502 WeakPolarHBondContact O-CB 3.45Å; T499-S502 PolarHBondContact O-N 3.4Å; T499-S502 WeakPolarHBondContact OG1-CB 3.36Å; T499-S502 PolarHBondContact OG1-N 2.66Å; T499-S502 VanDerWaalsContact OG1-N 3.15Å; T499-L503 PolarHBondContact O-N 3.13Å
500	P	96.8	Very high	95.3	Very high	33 Å²	33	44.6 Å²	44.6	21%	0.214	28%	0.278	C	S	.	.	H	α-helix	trans	-58.3	-39	174.4	-22.4	32.4	0	0	0	112.6	F475 S502 L503 L504	F475-P500 HydrophobicContact CB-CG 4.07Å; F475-P500 HydrophobicContact CD1-CG 4.42Å; F475-P500 HydrophobicContact CD2-CB 4.29Å; F475-P500 HydrophobicContact CD2-CG 3.65Å; F475-P500 HydrophobicContact CE2-CB 4.32Å; F475-P500 HydrophobicContact CE2-CG 4.17Å; F475-P500 HydrophobicContact CG-CG 3.8Å; P500-S502 VanDerWaalsContact C-N 3.34Å; P500-S502 PolarHBondContact O-N 2.94Å; P500-L503 PolarHBondContact O-N 3.06Å; P500-L504 WeakPolarHBondContact O-CG 3.31Å; P500-L504 PolarHBondContact O-N 3Å
501	A	96.2	Very high	95.2	Very high	67 Å²	67	49 Å²	49	55%	0.554	31%	0.314	S	S	*	.	H	α-helix	trans	-63.3	-39.3	177.8	0	0	0	0	0	112.1	T499 L503 L504 A505	T499-A501 VanDerWaalsContact C-N 3.26Å; T499-A501 PolarHBondContact O-N 3.03Å; A501-L503 VanDerWaalsContact C-N 3.31Å; A501-L503 PolarHBondContact O-N 3.05Å; A501-L504 PolarHBondContact O-N 3.23Å; A501-A505 WeakPolarHBondContact O-CB 3.41Å; A501-A505 PolarHBondContact O-N 3.45Å
502	S	97.5	Very high	95.3	Very high	43 Å²	43	50.1 Å²	50.1	30%	0.301	32%	0.317	S	S	.	.	H	α-helix	trans	-63.6	-37	175.1	175.1	0	0	0	0	112.2	T499 P500 A506	T499-S502 WeakPolarHBondContact O-CB 3.45Å; T499-S502 PolarHBondContact O-N 3.4Å; T499-S502 WeakPolarHBondContact OG1-CB 3.36Å; T499-S502 PolarHBondContact OG1-N 2.66Å; T499-S502 VanDerWaalsContact OG1-N 3.15Å; P500-S502 VanDerWaalsContact C-N 3.34Å; P500-S502 PolarHBondContact O-N 2.94Å; S502-A506 PolarHBondContact O-N 3.44Å
503	L	96.9	Very high	95.2	Very high	2 Å²	2	54.1 Å²	54.1	1%	0.01	34%	0.342	C	S	.	.	H	α-helix	trans	-70.6	-43.2	175.3	177.9	60.4	0	0	0	111.8	F475 Y497 T499 P500 A501 A506 Y507 L520 Y544	F475-L503 HydrophobicContact CE2-CD2 4.43Å; F475-L503 HydrophobicContact CZ-CB 4.12Å; F475-L503 HydrophobicContact CZ-CD2 3.8Å; Y497-L503 HydrophobicContact CD2-CD1 3.84Å; Y497-L503 HydrophobicContact CE2-CD1 4.11Å; Y497-L503 HydrophobicContact CG-CB 4.3Å; Y497-L503 HydrophobicContact CG-CD1 4.12Å; T499-L503 PolarHBondContact O-N 3.13Å; P500-L503 PolarHBondContact O-N 3.06Å; A501-L503 VanDerWaalsContact C-N 3.31Å; A501-L503 PolarHBondContact O-N 3.05Å; L503-A506 WeakPolarHBondContact O-CB 3.28Å; L503-A506 PolarHBondContact O-N 2.97Å; L503-Y507 HydrophobicContact CD1-CD2 4.09Å; L503-Y507 HydrophobicContact CD1-CE2 3.62Å; L503-Y507 HydrophobicContact CD2-CE2 4.01Å; L503-Y507 HydrophobicContact CG-CD2 3.96Å; L503-Y507 HydrophobicContact CG-CE2 3.61Å; L503-Y507 WeakPolarHBondContact O-CD2 3.48Å; L503-Y507 PolarHBondContact O-N 2.69Å; L503-L520 HydrophobicContact CD1-CD1 4.25Å; L503-L520 HydrophobicContact CD1-CD2 3.8Å; L503-Y544 HydrophobicContact CD2-CD2 3.91Å; L503-Y544 HydrophobicContact CD2-CE2 3.87Å; L503-Y544 HydrophobicContact CD2-CG 4.44Å
504	L	96.6	Very high	95	Very high	61 Å²	61	61.6 Å²	61.6	32%	0.319	37%	0.374	S	S	.	.	H	α-helix	trans	-61.3	-46.7	176.5	-75.4	168.8	0	0	0	111.6	P500 A501 A506 Y507 D508 Y544	P500-L504 WeakPolarHBondContact O-CG 3.31Å; P500-L504 PolarHBondContact O-N 3Å; A501-L504 PolarHBondContact O-N 3.23Å; L504-A506 PolarHBondContact O-N 2.96Å; L504-Y507 CarbonylContact O-C 3.53Å; L504-Y507 WeakPolarHBondContact O-CA 3.32Å; L504-Y507 WeakPolarHBondContact O-CB 3.37Å; L504-Y507 PolarHBondContact O-N 3.26Å; L504-D508 VanDerWaalsContact O-CG 3.31Å; L504-D508 PolarHBondContact O-N 2.96Å; L504-Y544 HydrophobicContact CD2-CD1 4.02Å; L504-Y544 HydrophobicContact CD2-CG 4.45Å; L504-Y544 WeakPolarHBondContact CD2-O 3.3Å; L504-Y544 HydrophobicContact CG-CD1 4.34Å
505	A	96.4	Very high	94.9	Very high	57 Å²	57	65.7 Å²	65.7	47%	0.471	39%	0.393	S	S	.	.	H	α-helix	trans	-58.4	-34.5	176.1	0	0	0	0	0	112.4	A501 A509	A501-A505 WeakPolarHBondContact O-CB 3.41Å; A501-A505 PolarHBondContact O-N 3.45Å; A505-A509 WeakPolarHBondContact O-CB 3.43Å; A505-A509 PolarHBondContact O-N 2.72Å
506	A	95.9	Very high	94.8	Very high	20 Å²	20	62.4 Å²	62.4	17%	0.165	37%	0.374	C	S	.	.	H	α-helix	trans	-71.3	-33.4	174.9	0	0	0	0	0	112.7	Y497 S502 L503 L504 C510 L519	Y497-A506 HydrophobicContact CD1-CB 4.17Å; Y497-A506 HydrophobicContact CE1-CB 3.43Å; Y497-A506 VanDerWaalsContact CE1-CB 3.43Å; S502-A506 PolarHBondContact O-N 3.44Å; L503-A506 WeakPolarHBondContact O-CB 3.28Å; L503-A506 PolarHBondContact O-N 2.97Å; L504-A506 PolarHBondContact O-N 2.96Å; A506-C510 PolarHBondContact O-SG 3.23Å; A506-L519 HydrophobicContact CB-CD2 4.04Å
507	Y	96.9	Very high	94.8	Very high	1 Å²	1	58.1 Å²	58.1	0%	0.004	36%	0.36	C	S	.	.	H	α-helix	trans	-71.3	-38.6	172.4	-76.8	-52.9	0	0	0	112.7	L503 L504 A509 C510 Q516 L519 L520 S541 Y544	L503-Y507 HydrophobicContact CD1-CD2 4.09Å; L503-Y507 HydrophobicContact CD1-CE2 3.62Å; L503-Y507 HydrophobicContact CD2-CE2 4.01Å; L503-Y507 HydrophobicContact CG-CD2 3.96Å; L503-Y507 HydrophobicContact CG-CE2 3.61Å; L503-Y507 WeakPolarHBondContact O-CD2 3.48Å; L503-Y507 PolarHBondContact O-N 2.69Å; L504-Y507 CarbonylContact O-C 3.53Å; L504-Y507 WeakPolarHBondContact O-CA 3.32Å; L504-Y507 WeakPolarHBondContact O-CB 3.37Å; L504-Y507 PolarHBondContact O-N 3.26Å; Y507-A509 VanDerWaalsContact C-N 3.26Å; Y507-A509 PolarHBondContact O-N 3.18Å; Y507-C510 WeakPolarHBondContact O-CB 3.49Å; Y507-C510 PolarHBondContact O-N 3.24Å; Y507-Q516 HydrophobicContact CD1-CB 3.84Å; Y507-Q516 HydrophobicContact CD1-CG 4.03Å; Y507-Q516 HydrophobicContact CE1-CB 4.21Å; Y507-Q516 WeakPolarHBondContact CE1-O 3.45Å; Y507-Q516 PolarHBondContact O-NE2 3.06Å; Y507-L519 HydrophobicContact CD1-CD2 3.53Å; Y507-L519 HydrophobicContact CE1-CB 4.13Å; Y507-L519 HydrophobicContact CE1-CD2 3.6Å; Y507-L519 HydrophobicContact CE1-CG 4.47Å; Y507-L519 HydrophobicContact CG-CD2 4.19Å; Y507-L520 WeakPolarHBondContact OH-CD1 3.49Å; Y507-S541 WeakPolarHBondContact OH-CA 3.47Å; Y507-S541 PolarHBondContact OH-N 2.89Å; Y507-Y544 HydrophobicContact CE2-CD2 4.34Å; Y507-Y544 HydrophobicContact CE2-CG 4.33Å
508	D	94.6	Very high	94.8	Very high	116 Å²	116	60.6 Å²	60.6	62%	0.62	38%	0.377	S	S	*	.	H	α-helix	trans	-66.9	-30.3	176.9	-65.3	-22.7	0	0	0	111.7	L504 C510	L504-D508 VanDerWaalsContact O-CG 3.31Å; L504-D508 PolarHBondContact O-N 2.96Å; D508-C510 VanDerWaalsContact C-N 3.28Å; D508-C510 PolarHBondContact O-N 3.17Å
509	A	94.8	Very high	94.9	Very high	86 Å²	86	59.9 Å²	59.9	71%	0.711	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.9	-14.6	175	0	0	0	0	0	113.9	A505 Y507	A505-A509 WeakPolarHBondContact O-CB 3.43Å; A505-A509 PolarHBondContact O-N 2.72Å; Y507-A509 VanDerWaalsContact C-N 3.26Å; Y507-A509 PolarHBondContact O-N 3.18Å
510	C	94.1	Very high	94.9	Very high	16 Å²	16	57.8 Å²	57.8	11%	0.108	36%	0.356	C	S	.	.			trans	-74	137.9	176.8	-66.7	0	0	0	0	110.8	A506 Y507 D508 E515 Q516	A506-C510 PolarHBondContact O-SG 3.23Å; Y507-C510 WeakPolarHBondContact O-CB 3.49Å; Y507-C510 PolarHBondContact O-N 3.24Å; D508-C510 VanDerWaalsContact C-N 3.28Å; D508-C510 PolarHBondContact O-N 3.17Å; C510-E515 HydrophobicContact CB-CB 4.18Å; C510-E515 HydrophobicContact CB-CG 4.08Å; C510-Q516 HydrophobicContact CB-CG 3.52Å
511	A	92.2	Very high	94.8	Very high	93 Å²	93	57.2 Å²	57.2	77%	0.769	35%	0.353	S	S	*	.	S	Bend	trans	-82	-23.5	-178.4	0	0	0	0	0	113	E515	A511-E515 PolarHBondContact N-OE2 3.4Å
512	T	93.7	Very high	94.7	Very high	68 Å²	68	58.3 Å²	58.3	42%	0.417	35%	0.353	S	S	.	.	S	Bend	trans	-134.9	150.8	-175	67.2	0	0	0	0	113.1	K514 E515 Q516	T512-K514 PolarHBondContact O-N 2.96Å; T512-E515 WeakPolarHBondContact O-CB 3.26Å; T512-E515 PolarHBondContact O-N 3.23Å; T512-E515 VanDerWaalsContact O-N 3.09Å; T512-E515 WeakPolarHBondContact OG1-CB 3.39Å; T512-E515 PolarHBondContact OG1-N 3.1Å; T512-Q516 PolarHBondContact O-N 3.21Å
513	P	91.1	Very high	94.5	Very high	96 Å²	96	57.2 Å²	57.2	62%	0.623	34%	0.343	S	S	*	.	H	α-helix	trans	-57.9	-32.3	175	-25.9	34.5	0	0	0	113.4	E515 Q516 E517	P513-E515 VanDerWaalsContact C-N 3.34Å; P513-Q516 WeakPolarHBondContact O-CB 3.44Å; P513-Q516 PolarHBondContact O-N 3.47Å; P513-E517 WeakPolarHBondContact O-CG 3.27Å; P513-E517 PolarHBondContact O-N 3.1Å
514	K	92.2	Very high	94.4	Very high	161 Å²	161	62.2 Å²	62.2	70%	0.7	37%	0.365	S	S	*	.	H	α-helix	trans	-70.4	-32.1	179.2	-166	167.3	-177.4	178.1	0	112.5	T512 E517 T518	T512-K514 PolarHBondContact O-N 2.96Å; K514-E517 PolarHBondContact O-N 3.41Å; K514-T518 PolarHBondContact O-N 2.93Å; K514-T518 PolarHBondContact O-OG1 3.01Å
515	E	92.8	Very high	94	Very high	88 Å²	88	59.9 Å²	59.9	41%	0.411	35%	0.354	S	S	.	.	H	α-helix	trans	-68.6	-42.9	172.6	-171.2	178	-164.4	0	0	110.6	C510 A511 T512 P513 E517 T518 L519	C510-E515 HydrophobicContact CB-CB 4.18Å; C510-E515 HydrophobicContact CB-CG 4.08Å; A511-E515 PolarHBondContact N-OE2 3.4Å; T512-E515 WeakPolarHBondContact O-CB 3.26Å; T512-E515 PolarHBondContact O-N 3.23Å; T512-E515 VanDerWaalsContact O-N 3.09Å; T512-E515 WeakPolarHBondContact OG1-CB 3.39Å; T512-E515 PolarHBondContact OG1-N 3.1Å; P513-E515 VanDerWaalsContact C-N 3.34Å; E515-E517 VanDerWaalsContact C-N 3.34Å; E515-E517 PolarHBondContact O-N 3.29Å; E515-T518 CarbonylContact O-C 3.38Å; E515-T518 PolarHBondContact O-N 3.4Å; E515-T518 VanDerWaalsContact O-N 3.11Å; E515-T518 PolarHBondContact O-OG1 3.49Å; E515-L519 PolarHBondContact O-N 3.06Å
516	Q	92.6	Very high	93.5	Very high	40 Å²	40	58.2 Å²	58.2	19%	0.187	34%	0.342	C	S	.	.	H	α-helix	trans	-57.8	-44.7	171.8	-62.7	176	-21.5	0	0	111.6	Y507 C510 T512 P513 T518 L519 S541	Y507-Q516 HydrophobicContact CD1-CB 3.84Å; Y507-Q516 HydrophobicContact CD1-CG 4.03Å; Y507-Q516 HydrophobicContact CE1-CB 4.21Å; Y507-Q516 WeakPolarHBondContact CE1-O 3.45Å; Y507-Q516 PolarHBondContact O-NE2 3.06Å; C510-Q516 HydrophobicContact CB-CG 3.52Å; T512-Q516 PolarHBondContact O-N 3.21Å; P513-Q516 WeakPolarHBondContact O-CB 3.44Å; P513-Q516 PolarHBondContact O-N 3.47Å; Q516-T518 PolarHBondContact O-N 3.1Å; Q516-L519 PolarHBondContact O-N 3.07Å; Q516-S541 WeakPolarHBondContact O-CB 3.43Å
517	E	94.9	Very high	92.9	Very high	60 Å²	60	68.6 Å²	68.6	28%	0.28	38%	0.377	S	S	.	.	H	α-helix	trans	-60.8	-29.2	177.3	-75.2	-169.2	-166.4	0	0	113.6	P513 K514 E515 S537 R538	P513-E517 WeakPolarHBondContact O-CG 3.27Å; P513-E517 PolarHBondContact O-N 3.1Å; K514-E517 PolarHBondContact O-N 3.41Å; E515-E517 VanDerWaalsContact C-N 3.34Å; E515-E517 PolarHBondContact O-N 3.29Å; E517-S537 CarbonylContact O-C 3.52Å; E517-S537 WeakPolarHBondContact O-CB 3.25Å; E517-S537 PolarHBondContact O-OG 3.14Å; E517-R538 HydrophobicContact CG-CB 4.5Å; E517-R538 HydrophobicContact CG-CG 4.12Å; E517-R538 PolarHBondContact O-N 3.22Å; E517-R538 IonicContact OE1-NE 3.38Å; E517-R538 IonicContact OE2-CZ 3.76Å; E517-R538 IonicContact OE2-NE 3.07Å; E517-R538 PolarHBondContact OE2-NE 2.92Å; E517-R538 IonicContact OE2-NH2 4Å; E517-R538 PolarHBondContact OE2-NH2 3.35Å; E517-R538 VanDerWaalsContact OE2-NH2 3.11Å
518	T	95.3	Very high	92.3	Very high	66 Å²	66	74.5 Å²	74.5	41%	0.405	41%	0.408	S	S	.	.	H	α-helix	trans	-103.2	-10.6	-174.6	53.9	0	0	0	0	114	K514 E515 Q516 L520 S521	K514-T518 PolarHBondContact O-N 2.93Å; K514-T518 PolarHBondContact O-OG1 3.01Å; E515-T518 CarbonylContact O-C 3.38Å; E515-T518 PolarHBondContact O-N 3.4Å; E515-T518 VanDerWaalsContact O-N 3.11Å; E515-T518 PolarHBondContact O-OG1 3.49Å; Q516-T518 PolarHBondContact O-N 3.1Å; T518-L520 PolarHBondContact O-N 3.17Å; T518-L520 VanDerWaalsContact O-N 3.09Å; T518-S521 VanDerWaalsContact O-CB 3.28Å; T518-S521 WeakPolarHBondContact O-CB 3.46Å; T518-S521 PolarHBondContact O-N 3.44Å; T518-S521 PolarHBondContact O-OG 3.05Å
519	L	95.4	Very high	92	Very high	40 Å²	40	74.6 Å²	74.6	21%	0.209	41%	0.405	C	S	.	.	T	Hydrogen-bonded Turn	trans	-49	-40.9	-176	-177.3	65.7	0	0	0	113.8	A506 Y507 E515 Q516	A506-L519 HydrophobicContact CB-CD2 4.04Å; Y507-L519 HydrophobicContact CD1-CD2 3.53Å; Y507-L519 HydrophobicContact CE1-CB 4.13Å; Y507-L519 HydrophobicContact CE1-CD2 3.6Å; Y507-L519 HydrophobicContact CE1-CG 4.47Å; Y507-L519 HydrophobicContact CG-CD2 4.19Å; E515-L519 PolarHBondContact O-N 3.06Å; Q516-L519 PolarHBondContact O-N 3.07Å
520	L	96.1	Very high	91.8	Very high	0 Å²	0	78.9 Å²	78.9	0%	0	40%	0.402	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.1	-6.6	-176.1	-51.9	-179.7	0	0	0	113	L493 Y497 L503 Y507 T518 T522 I523 L532 S537 L540	L493-L520 HydrophobicContact CD2-CB 4.28Å; L493-L520 HydrophobicContact CD2-CD1 3.85Å; L493-L520 HydrophobicContact CD2-CD2 4.07Å; L493-L520 HydrophobicContact CD2-CG 4.3Å; Y497-L520 HydrophobicContact CD2-CD2 4.05Å; Y497-L520 HydrophobicContact CE2-CD2 3.51Å; L503-L520 HydrophobicContact CD1-CD1 4.25Å; L503-L520 HydrophobicContact CD1-CD2 3.8Å; Y507-L520 WeakPolarHBondContact OH-CD1 3.49Å; T518-L520 PolarHBondContact O-N 3.17Å; T518-L520 VanDerWaalsContact O-N 3.09Å; L520-T522 PolarHBondContact O-N 2.87Å; L520-I523 HydrophobicContact CB-CD1 4.06Å; L520-I523 HydrophobicContact CD2-CD1 3.61Å; L520-I523 HydrophobicContact CG-CD1 4.44Å; L520-I523 WeakPolarHBondContact O-CB 3.49Å; L520-I523 PolarHBondContact O-N 3.38Å; L520-L532 HydrophobicContact CB-CD2 3.83Å; L520-L532 WeakPolarHBondContact O-CB 3.28Å; L520-L532 WeakPolarHBondContact O-CD2 3.4Å; L520-S537 WeakPolarHBondContact CA-OG 3.46Å; L520-S537 WeakPolarHBondContact CB-OG 3.4Å; L520-S537 PolarHBondContact N-OG 2.94Å; L520-L540 HydrophobicContact CD1-CB 3.85Å; L520-L540 HydrophobicContact CD1-CD1 3.64Å; L520-L540 HydrophobicContact CD1-CG 4.41Å
521	S	95.1	Very high	91.8	Very high	20 Å²	20	82.2 Å²	82.2	14%	0.14	42%	0.419	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-28.8	-168.6	68.5	0	0	0	0	113.4	T518 N531 G533 S537	T518-S521 VanDerWaalsContact O-CB 3.28Å; T518-S521 WeakPolarHBondContact O-CB 3.46Å; T518-S521 PolarHBondContact O-N 3.44Å; T518-S521 PolarHBondContact O-OG 3.05Å; S521-N531 WeakPolarHBondContact O-CB 3.37Å; S521-G533 PolarHBondContact O-N 3.29Å; S521-S537 PolarHBondContact N-OG 3.48Å
522	T	94	Very high	91.8	Very high	91 Å²	91	78.2 Å²	78.2	56%	0.558	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.8	-5.1	-176.5	56.9	0	0	0	0	113.8	L520 K524	L520-T522 PolarHBondContact O-N 2.87Å; T522-K524 PolarHBondContact O-N 2.87Å
523	I	94.1	Very high	91.8	Very high	20 Å²	20	75.8 Å²	75.8	10%	0.103	37%	0.373	C	S	.	.			trans	-60	129.6	178.5	-67.8	177.9	0	0	0	109.4	A492 L493 R496 Y497 L520 N531 L532	A492-I523 HydrophobicContact CB-CG2 3.95Å; L493-I523 HydrophobicContact CD2-CD1 3.64Å; R496-I523 HydrophobicContact CB-CD1 4.47Å; Y497-I523 HydrophobicContact CE2-CD1 4.21Å; L520-I523 HydrophobicContact CB-CD1 4.06Å; L520-I523 HydrophobicContact CD2-CD1 3.61Å; L520-I523 HydrophobicContact CG-CD1 4.44Å; L520-I523 WeakPolarHBondContact O-CB 3.49Å; L520-I523 PolarHBondContact O-N 3.38Å; I523-N531 CarbonylContact O-C 3.58Å; I523-N531 WeakPolarHBondContact O-CA 3.35Å; I523-L532 HydrophobicContact CB-CB 4.44Å; I523-L532 PolarHBondContact O-N 3.32Å
524	K	93.6	Very high	92	Very high	107 Å²	107	75.3 Å²	75.3	47%	0.465	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	126.3	-177.5	-53.1	-67.6	177.1	175	0	109.9	A492 T522 Q529 R530 N531	A492-K524 VanDerWaalsContact CB-O 3.23Å; A492-K524 WeakPolarHBondContact CB-O 3.37Å; T522-K524 PolarHBondContact O-N 2.87Å; K524-Q529 HydrophobicContact CB-CB 4.26Å; K524-Q529 VanDerWaalsContact CD-O 3.28Å; K524-Q529 WeakPolarHBondContact CD-O 3.42Å; K524-R530 CarbonylContact C-O 3.41Å; K524-N531 WeakPolarHBondContact CD-OD1 3.27Å; K524-N531 WeakPolarHBondContact CE-OD1 3.22Å; K524-N531 PolarHBondContact NZ-OD1 3.36Å
525	C	89.3	Confident	92.1	Very high	12 Å²	12	71 Å²	71	8%	0.081	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	138.6	-174.1	-56.1	0	0	0	0	111.9	K489 A492 R530	K489-C525 HydrophobicContact CG-CB 3.94Å; A492-C525 HydrophobicContact CB-CB 4.27Å; C525-R530 PolarHBondContact N-O 3Å; C525-R530 PolarHBondContact O-N 2.95Å; C525-R530 VanDerWaalsContact O-N 3.16Å
526	G	85.9	Confident	92.2	Very high	22 Å²	22	67.9 Å²	67.9	23%	0.227	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	66.5	-173.8	173.3	0	0	0	0	0	114.1	L528 Q529	G526-L528 VanDerWaalsContact C-N 3.27Å; G526-L528 PolarHBondContact O-N 3.49Å; G526-Q529 PolarHBondContact O-N 2.87Å; G526-Q529 VanDerWaalsContact O-N 3.14Å; G526-Q529 PolarHBondContact O-NE2 3.48Å
527	R	81.5	Confident	92.4	Very high	238 Å²	238	66 Å²	66	90%	0.898	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-30.8	-175	-64.1	-176.7	179.2	-171.4	-2.3	114	Q529	R527-Q529 VanDerWaalsContact C-N 3.25Å; R527-Q529 PolarHBondContact O-N 3.35Å
528	L	85.1	Confident	92.4	Very high	124 Å²	124	68.7 Å²	68.7	65%	0.649	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.2	3.7	-179	-63.2	172.6	0	0	0	112.8	G526 R530	G526-L528 VanDerWaalsContact C-N 3.27Å; G526-L528 PolarHBondContact O-N 3.49Å; L528-R530 HydrophobicContact CB-CG 4.05Å; L528-R530 PolarHBondContact O-N 3.45Å; L528-R530 VanDerWaalsContact O-N 3.12Å
529	Q	88.1	Confident	92.5	Very high	119 Å²	119	68.4 Å²	68.4	56%	0.556	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.5	42.2	178.4	-62.3	-65.9	-36.5	0	0	112.4	K524 G526 R527	K524-Q529 HydrophobicContact CB-CB 4.26Å; K524-Q529 VanDerWaalsContact CD-O 3.28Å; K524-Q529 WeakPolarHBondContact CD-O 3.42Å; G526-Q529 PolarHBondContact O-N 2.87Å; G526-Q529 VanDerWaalsContact O-N 3.14Å; G526-Q529 PolarHBondContact O-NE2 3.48Å; R527-Q529 VanDerWaalsContact C-N 3.25Å; R527-Q529 PolarHBondContact O-N 3.35Å
530	R	90.6	Very high	92.5	Very high	175 Å²	175	66.5 Å²	66.5	66%	0.66	34%	0.337	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80	142.4	-178.8	-73	-177.4	176.4	160.7	-1.8	110.1	K524 C525 L528	K524-R530 CarbonylContact C-O 3.41Å; C525-R530 PolarHBondContact N-O 3Å; C525-R530 PolarHBondContact O-N 2.95Å; C525-R530 VanDerWaalsContact O-N 3.16Å; L528-R530 HydrophobicContact CB-CG 4.05Å; L528-R530 PolarHBondContact O-N 3.45Å; L528-R530 VanDerWaalsContact O-N 3.12Å
531	N	94.5	Very high	92.4	Very high	87 Å²	87	66.8 Å²	66.8	47%	0.465	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.6	140.2	174.3	-70	0.6	0	0	0	110.8	S521 I523 K524 G533	S521-N531 WeakPolarHBondContact O-CB 3.37Å; I523-N531 CarbonylContact O-C 3.58Å; I523-N531 WeakPolarHBondContact O-CA 3.35Å; K524-N531 WeakPolarHBondContact CD-OD1 3.27Å; K524-N531 WeakPolarHBondContact CE-OD1 3.22Å; K524-N531 PolarHBondContact NZ-OD1 3.36Å; N531-G533 PolarHBondContact O-N 3.12Å
532	L	92.9	Very high	92.4	Very high	8 Å²	8	70.9 Å²	70.9	4%	0.042	36%	0.356	C	S	.	.			trans	-55.2	-38.5	172.1	-176.6	68.3	0	0	0	111	K489 L493 L520 I523 L536 L540	K489-L532 HydrophobicContact CB-CD1 4.01Å; K489-L532 HydrophobicContact CD-CD1 3.87Å; K489-L532 HydrophobicContact CG-CD1 4.05Å; L493-L532 HydrophobicContact CD1-CD2 4.35Å; L493-L532 HydrophobicContact CD2-CD2 3.99Å; L493-L532 HydrophobicContact CG-CD2 4.39Å; L520-L532 HydrophobicContact CB-CD2 3.83Å; L520-L532 WeakPolarHBondContact O-CB 3.28Å; L520-L532 WeakPolarHBondContact O-CD2 3.4Å; I523-L532 HydrophobicContact CB-CB 4.44Å; I523-L532 PolarHBondContact O-N 3.32Å; L532-L536 HydrophobicContact CD1-CB 4.33Å; L532-L536 HydrophobicContact CD1-CD1 3.88Å; L532-L536 HydrophobicContact CD2-CB 4.43Å; L532-L536 HydrophobicContact CG-CB 4.04Å; L532-L536 HydrophobicContact CG-CD1 4.37Å; L532-L540 HydrophobicContact CD2-CD1 4.44Å
533	G	93.8	Very high	92.4	Very high	17 Å²	17	69.7 Å²	69.7	18%	0.175	35%	0.346	C	S	.	.			trans	94.8	155.9	174.6	0	0	0	0	0	113.3	S521 N531 A535 S537	S521-G533 PolarHBondContact O-N 3.29Å; N531-G533 PolarHBondContact O-N 3.12Å; G533-A535 VanDerWaalsContact C-N 3.33Å; G533-A535 PolarHBondContact O-N 3.23Å; G533-S537 PolarHBondContact O-N 3.06Å
534	P	94.1	Very high	92.5	Very high	87 Å²	87	71 Å²	71	57%	0.565	35%	0.35	S	S	*	.	H	α-helix	trans	-66.9	-31.9	-172.9	26.1	-34.6	0	0	0	113.1	S537 R538	P534-S537 PolarHBondContact O-N 2.78Å; P534-R538 WeakPolarHBondContact O-CB 3.38Å; P534-R538 PolarHBondContact O-N 3.18Å
535	A	94.6	Very high	92.4	Very high	70 Å²	70	67.3 Å²	67.3	58%	0.579	34%	0.337	S	S	*	.	H	α-helix	trans	-63	-48.6	-179.1	0	0	0	0	0	112.4	G533 R538 T539	G533-A535 VanDerWaalsContact C-N 3.33Å; G533-A535 PolarHBondContact O-N 3.23Å; A535-R538 PolarHBondContact O-N 3.24Å; A535-T539 PolarHBondContact O-N 2.83Å; A535-T539 VanDerWaalsContact O-N 3.08Å; A535-T539 PolarHBondContact O-OG1 3.26Å; A535-T539 VanDerWaalsContact O-OG1 3.08Å
536	L	95	Very high	92.5	Very high	22 Å²	22	69.2 Å²	69.2	12%	0.115	35%	0.351	C	S	.	.	H	α-helix	trans	-71.2	-36	178.6	-73.5	175.3	0	0	0	112	V485 K489 L532 R538 T539 L540	V485-L536 HydrophobicContact CG2-CD2 4.26Å; K489-L536 HydrophobicContact CD-CD1 4.06Å; L532-L536 HydrophobicContact CD1-CB 4.33Å; L532-L536 HydrophobicContact CD1-CD1 3.88Å; L532-L536 HydrophobicContact CD2-CB 4.43Å; L532-L536 HydrophobicContact CG-CB 4.04Å; L532-L536 HydrophobicContact CG-CD1 4.37Å; L536-R538 VanDerWaalsContact C-N 3.35Å; L536-T539 PolarHBondContact O-N 3.16Å; L536-L540 WeakPolarHBondContact O-CG 3.16Å; L536-L540 PolarHBondContact O-N 3.47Å
537	S	96.7	Very high	92.7	Very high	0 Å²	0	78.8 Å²	78.8	0%	0	38%	0.382	C	S	.	.	H	α-helix	trans	-58.8	-46.6	174	-173.8	0	0	0	0	111.4	E517 L520 S521 G533 P534 L540 S541	E517-S537 CarbonylContact O-C 3.52Å; E517-S537 WeakPolarHBondContact O-CB 3.25Å; E517-S537 PolarHBondContact O-OG 3.14Å; L520-S537 WeakPolarHBondContact CA-OG 3.46Å; L520-S537 WeakPolarHBondContact CB-OG 3.4Å; L520-S537 PolarHBondContact N-OG 2.94Å; S521-S537 PolarHBondContact N-OG 3.48Å; G533-S537 PolarHBondContact O-N 3.06Å; P534-S537 PolarHBondContact O-N 2.78Å; S537-L540 PolarHBondContact O-N 3.42Å; S537-S541 PolarHBondContact O-N 2.97Å
538	R	95.6	Very high	93	Very high	118 Å²	118	71.6 Å²	71.6	45%	0.445	37%	0.368	S	S	.	.	H	α-helix	trans	-60	-48.7	174.1	-178.8	-178.6	-66	150.1	1.3	112.1	E517 P534 A535 L536 L540 S541 Q542	E517-R538 HydrophobicContact CG-CB 4.5Å; E517-R538 HydrophobicContact CG-CG 4.12Å; E517-R538 PolarHBondContact O-N 3.22Å; E517-R538 IonicContact OE1-NE 3.38Å; E517-R538 IonicContact OE2-CZ 3.76Å; E517-R538 IonicContact OE2-NE 3.07Å; E517-R538 PolarHBondContact OE2-NE 2.92Å; E517-R538 IonicContact OE2-NH2 4Å; E517-R538 PolarHBondContact OE2-NH2 3.35Å; E517-R538 VanDerWaalsContact OE2-NH2 3.11Å; P534-R538 WeakPolarHBondContact O-CB 3.38Å; P534-R538 PolarHBondContact O-N 3.18Å; A535-R538 PolarHBondContact O-N 3.24Å; L536-R538 VanDerWaalsContact C-N 3.35Å; R538-L540 VanDerWaalsContact C-N 3.29Å; R538-L540 PolarHBondContact O-N 2.91Å; R538-S541 WeakPolarHBondContact CA-OG 3.29Å; R538-S541 PolarHBondContact O-N 2.92Å; R538-S541 VanDerWaalsContact O-N 3.15Å; R538-S541 PolarHBondContact O-OG 3.43Å; R538-Q542 HydrophobicContact CG-CG 4.49Å; R538-Q542 WeakPolarHBondContact O-CG 3.49Å; R538-Q542 PolarHBondContact O-N 2.99Å
539	T	95.8	Very high	93.2	Very high	59 Å²	59	71.4 Å²	71.4	36%	0.362	37%	0.374	S	S	.	.	H	α-helix	trans	-58.5	-41.2	179.4	-57.7	0	0	0	0	112.3	V482 A535 L536 Q542 L543	V482-T539 HydrophobicContact CG1-CG2 3.77Å; A535-T539 PolarHBondContact O-N 2.83Å; A535-T539 VanDerWaalsContact O-N 3.08Å; A535-T539 PolarHBondContact O-OG1 3.26Å; A535-T539 VanDerWaalsContact O-OG1 3.08Å; L536-T539 PolarHBondContact O-N 3.16Å; T539-Q542 PolarHBondContact O-N 3Å; T539-L543 PolarHBondContact O-N 2.98Å; T539-L543 VanDerWaalsContact O-N 3.08Å
540	L	95.5	Very high	93.2	Very high	0 Å²	0	71.1 Å²	71.1	0%	0	38%	0.376	C	S	.	.	H	α-helix	trans	-70	-38.9	176.7	-69.1	172.8	0	0	0	111.9	L479 V482 L493 L520 L532 L536 S537 R538 Q542 L543 Y544	L479-L540 HydrophobicContact CD2-CD2 3.94Å; V482-L540 HydrophobicContact CG2-CD2 4.02Å; L493-L540 HydrophobicContact CD1-CD1 3.83Å; L493-L540 HydrophobicContact CD2-CD1 4.4Å; L520-L540 HydrophobicContact CD1-CB 3.85Å; L520-L540 HydrophobicContact CD1-CD1 3.64Å; L520-L540 HydrophobicContact CD1-CG 4.41Å; L532-L540 HydrophobicContact CD2-CD1 4.44Å; L536-L540 WeakPolarHBondContact O-CG 3.16Å; L536-L540 PolarHBondContact O-N 3.47Å; S537-L540 PolarHBondContact O-N 3.42Å; R538-L540 VanDerWaalsContact C-N 3.29Å; R538-L540 PolarHBondContact O-N 2.91Å; L540-Q542 VanDerWaalsContact C-N 3.31Å; L540-Q542 PolarHBondContact O-N 3.28Å; L540-L543 HydrophobicContact CD2-CD2 4.49Å; L540-L543 WeakPolarHBondContact O-CB 3.48Å; L540-L543 PolarHBondContact O-N 3.02Å; L540-L543 VanDerWaalsContact O-N 3.17Å; L540-Y544 HydrophobicContact CD2-CE2 4.37Å; L540-Y544 WeakPolarHBondContact O-CD2 3.4Å; L540-Y544 PolarHBondContact O-N 2.87Å
541	S	95.6	Very high	92.6	Very high	6 Å²	6	72.8 Å²	72.8	4%	0.042	41%	0.406	C	S	.	.	H	α-helix	trans	-61	-41.4	174.4	70.2	0	0	0	0	111.7	Y507 Q516 S537 R538 L543 Y544 C545	Y507-S541 WeakPolarHBondContact OH-CA 3.47Å; Y507-S541 PolarHBondContact OH-N 2.89Å; Q516-S541 WeakPolarHBondContact O-CB 3.43Å; S537-S541 PolarHBondContact O-N 2.97Å; R538-S541 WeakPolarHBondContact CA-OG 3.29Å; R538-S541 PolarHBondContact O-N 2.92Å; R538-S541 VanDerWaalsContact O-N 3.15Å; R538-S541 PolarHBondContact O-OG 3.43Å; S541-L543 VanDerWaalsContact C-N 3.33Å; S541-L543 PolarHBondContact O-N 2.66Å; S541-Y544 PolarHBondContact O-N 3.43Å; S541-C545 WeakPolarHBondContact O-CA 3.24Å; S541-C545 WeakPolarHBondContact O-CB 3.39Å; S541-C545 PolarHBondContact O-N 3.48Å; S541-C545 PolarHBondContact O-SG 2.91Å
542	Q	93.9	Very high	92.5	Very high	106 Å²	106	72.1 Å²	72.1	50%	0.495	40%	0.403	S	S	.	.	H	α-helix	trans	-62.3	-41.3	175.1	-71.5	172.5	-18.1	0	0	111.5	R538 T539 L540 Y544 S546	R538-Q542 HydrophobicContact CG-CG 4.49Å; R538-Q542 WeakPolarHBondContact O-CG 3.49Å; R538-Q542 PolarHBondContact O-N 2.99Å; T539-Q542 PolarHBondContact O-N 3Å; L540-Q542 VanDerWaalsContact C-N 3.31Å; L540-Q542 PolarHBondContact O-N 3.28Å; Q542-Y544 PolarHBondContact O-N 3.18Å; Q542-S546 WeakPolarHBondContact O-CB 3.37Å; Q542-S546 PolarHBondContact O-N 3.11Å; Q542-S546 PolarHBondContact O-OG 3.13Å
543	L	95.2	Very high	92.5	Very high	66 Å²	66	75.5 Å²	75.5	35%	0.346	42%	0.422	S	S	.	.	H	α-helix	trans	-64.5	-39	179.6	-178.7	65.6	0	0	0	113.2	V482 T539 L540 S541 L550	V482-L543 HydrophobicContact CG2-CD2 4.01Å; T539-L543 PolarHBondContact O-N 2.98Å; T539-L543 VanDerWaalsContact O-N 3.08Å; L540-L543 HydrophobicContact CD2-CD2 4.49Å; L540-L543 WeakPolarHBondContact O-CB 3.48Å; L540-L543 PolarHBondContact O-N 3.02Å; L540-L543 VanDerWaalsContact O-N 3.17Å; S541-L543 VanDerWaalsContact C-N 3.33Å; S541-L543 PolarHBondContact O-N 2.66Å; L543-L550 HydrophobicContact CD1-CD1 3.62Å; L543-L550 HydrophobicContact CD1-CD2 4.27Å
544	Y	94.6	Very high	92.4	Very high	48 Å²	48	78.7 Å²	78.7	19%	0.188	44%	0.436	C	S	.	.	H	α-helix	trans	-98.7	-21.5	-173.1	-75.4	-74.1	0	0	0	114.3	F475 L479 L503 L504 Y507 L540 S541 Q542	F475-Y544 WeakPolarHBondContact CE2-OH 3.38Å; L479-Y544 HydrophobicContact CD2-CE2 4.33Å; L503-Y544 HydrophobicContact CD2-CD2 3.91Å; L503-Y544 HydrophobicContact CD2-CE2 3.87Å; L503-Y544 HydrophobicContact CD2-CG 4.44Å; L504-Y544 HydrophobicContact CD2-CD1 4.02Å; L504-Y544 HydrophobicContact CD2-CG 4.45Å; L504-Y544 WeakPolarHBondContact CD2-O 3.3Å; L504-Y544 HydrophobicContact CG-CD1 4.34Å; Y507-Y544 HydrophobicContact CE2-CD2 4.34Å; Y507-Y544 HydrophobicContact CE2-CG 4.33Å; L540-Y544 HydrophobicContact CD2-CE2 4.37Å; L540-Y544 WeakPolarHBondContact O-CD2 3.4Å; L540-Y544 PolarHBondContact O-N 2.87Å; S541-Y544 PolarHBondContact O-N 3.43Å; Q542-Y544 PolarHBondContact O-N 3.18Å
545	C	92.9	Very high	92.3	Very high	29 Å²	29	78.2 Å²	78.2	20%	0.196	43%	0.428	C	S	.	.	H	α-helix	trans	-109	-7.6	-174.7	-50.3	0	0	0	0	113.5	S541 Y547	S541-C545 WeakPolarHBondContact O-CA 3.24Å; S541-C545 WeakPolarHBondContact O-CB 3.39Å; S541-C545 PolarHBondContact O-N 3.48Å; S541-C545 PolarHBondContact O-SG 2.91Å; C545-Y547 WeakPolarHBondContact O-CD2 3.36Å; C545-Y547 PolarHBondContact O-N 3.12Å
546	S	91.6	Very high	92.2	Very high	52 Å²	52	78.8 Å²	78.8	36%	0.364	42%	0.419	S	S	.	.			trans	-73.4	117.9	177.4	66.4	0	0	0	0	111.1	Q542 S548 L550	Q542-S546 WeakPolarHBondContact O-CB 3.37Å; Q542-S546 PolarHBondContact O-N 3.11Å; Q542-S546 PolarHBondContact O-OG 3.13Å; S546-S548 VanDerWaalsContact C-N 3.32Å; S546-L550 WeakPolarHBondContact OG-CD2 3.41Å
547	Y	88.3	Confident	92	Very high	224 Å²	224	82.5 Å²	82.5	88%	0.878	44%	0.439	S	S	*	.			trans	-74.4	-23.9	173.8	-67.5	-88.7	0	0	0	113	C545	C545-Y547 WeakPolarHBondContact O-CD2 3.36Å; C545-Y547 PolarHBondContact O-N 3.12Å
548	S	89.3	Confident	91.6	Very high	87 Å²	87	88.4 Å²	88.4	61%	0.608	47%	0.47	S	S	*	.	S	Bend	trans	-80.8	156.2	177.4	-56.9	0	0	0	0	111.8	S546 L550	S546-S548 VanDerWaalsContact C-N 3.32Å; S548-L550 PolarHBondContact O-N 2.66Å
549	P	89.3	Confident	91.3	Very high	120 Å²	120	86.2 Å²	86.2	78%	0.779	47%	0.472	S	S	*	.	P	Polyproline II helix	trans	-52.6	131.3	171.2	-25.9	34.7	0	0	0	112
550	L	87	Confident	91	Very high	112 Å²	112	88.4 Å²	88.4	59%	0.586	48%	0.481	S	S	*	.	P	Polyproline II helix	trans	-63.6	137.8	178.6	-65.3	166.4	0	0	0	110.8	L543 S546 S548	L543-L550 HydrophobicContact CD1-CD1 3.62Å; L543-L550 HydrophobicContact CD1-CD2 4.27Å; S546-L550 WeakPolarHBondContact OG-CD2 3.41Å; S548-L550 PolarHBondContact O-N 2.66Å
551	T	78.1	Confident	90.5	Very high	211 Å²	211	96.5 Å²	96.5	100%	1.294	53%	0.525	S	S	*	.			trans	-108.5	0	-179	57.4	0	0	0	0	113.7

Retrieved 551 of 551 residues in 190.3 ms (Link to these results)

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